tert-butyl N-[1-[[2-(butylamino)-1-(4-ethynylphenyl)-2-oxidanylidene-ethyl]-methyl-amino]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[[2-(butylamino)-1-(4-ethynylphenyl)-2-oxidanylidene-ethyl]-methyl-amino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-[[2-(butylamino)-1-(4-ethynylphenyl)-2-oxo-ethyl]-methyl-amino]-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[1-[[2-(butylamino)-1-(4-ethynylphenyl)-2-oxoethyl]-methylamino]-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[[2-(butylamino)-1-(4-ethynylphenyl)-2-oxoethyl]-methylamino]-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[[2-(butylamino)-1-(4-ethynylphenyl)-2-keto-ethyl]-methyl-amino]-2-keto-1-methyl-ethyl]carbamic acid tert-butyl ester Formula: C23H33N3O4 MolecularWeight: 415.52582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C1=CC=C(C=C1)C#C)N(C)C(=O)C(C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCNC(=O)C(C1=CC=C(C=C1)C#C)N(C)C(=O)C(C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C23H33N3O4/c1-8-10-15-24-20(27)19(18-13-11-17(9-2)12-14-18)26(7)21(28)16(3)25-22(29)30-23(4,5)6/h2,11-14,16,19H,8,10,15H2,1,3-7H3,(H,24,27)(H,25,29)