N-[5-[bis(azanyl)methylideneamino]-1-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]-1-oxidanylidene-pentan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: N-[5-[bis(azanyl)methylideneamino]-1-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]-1-oxidanylidene-pentan-2-yl]pyrrolidine-2-carboxamide Openeye Name: N-[4-guanidino-1-[(4-methyl-2-oxo-chromen-7-yl)carbamoyl]butyl]pyrrolidine-2-carboxamide CAS Name: N-[5-(diaminomethylideneamino)-1-[(4-methyl-2-oxo-1-benzopyran-7-yl)amino]-1-oxopentan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(diaminomethylideneamino)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]pyrrolidine-2-carboxamide Traditional Name: N-[4-guanidino-1-[(2-keto-4-methyl-chromen-7-yl)carbamoyl]butyl]pyrrolidine-2-carboxamide Formula: C21H28N6O4 MolecularWeight: 428.48482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CCCN=C(N)N)NC(=O)C3CCCN3

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CCCN=C(N)N)NC(=O)C3CCCN3

InChI

InChI=1S/C21H28N6O4/c1-12-10-18(28)31-17-11-13(6-7-14(12)17)26-20(30)16(5-3-9-25-21(22)23)27-19(29)15-4-2-8-24-15/h6-7,10-11,15-16,24H,2-5,8-9H2,1H3,(H,26,30)(H,27,29)(H4,22,23,25)