tert-butyl N-[2-[[6-azanyl-1-[[5-[bis(azanyl)methylideneamino]-1-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-2-oxidanylidene-ethyl]carbamate hydrochloride

Systemtic Name: tert-butyl N-[2-[[6-azanyl-1-[[5-[bis(azanyl)methylideneamino]-1-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-2-oxidanylidene-ethyl]carbamate hydrochloride Openeye Name: tert-butyl N-[2-[[5-amino-1-[[4-guanidino-1-[(4-methyl-2-oxo-chromen-7-yl)carbamoyl]butyl]carbamoyl]pentyl]amino]-2-oxo-ethyl]carbamate hydrochloride CAS Name: N-[2-[[6-amino-1-[[5-(diaminomethylideneamino)-1-[(4-methyl-2-oxo-1-benzopyran-7-yl)amino]-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-2-oxoethyl]carbamic acid tert-butyl ester hydrochloride IUPAC Name: tert-butyl N-[2-[[6-amino-1-[[5-(diaminomethylideneamino)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-2-oxoethyl]carbamate hydrochloride Traditional Name: N-[2-[[5-amino-1-[[4-guanidino-1-[(2-keto-4-methyl-chromen-7-yl)carbamoyl]butyl]carbamoyl]pentyl]amino]-2-keto-ethyl]carbamic acid tert-butyl ester hydrochloride Formula: C29H45ClN8O7 MolecularWeight: 653.17

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CCCN=C(N)N)NC(=O)C(CCCCN)NC(=O)CNC(=O)OC(C)(C)C.Cl

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CCCN=C(N)N)NC(=O)C(CCCCN)NC(=O)CNC(=O)OC(C)(C)C.Cl

InChI

InChI=1S/C29H44N8O7.ClH/c1-17-14-24(39)43-22-15-18(10-11-19(17)22)35-25(40)21(9-7-13-33-27(31)32)37-26(41)20(8-5-6-12-30)36-23(38)16-34-28(42)44-29(2,3)4;/h10-11,14-15,20-21H,5-9,12-13,16,30H2,1-4H3,(H,34,42)(H,35,40)(H,36,38)(H,37,41)(H4,31,32,33);1H