5-[bis(azanyl)methylideneamino]-2-(2,2-diphenylethanoylamino)-N-(4-ethanoylphenyl)-N-methyl-pentanamide

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-(2,2-diphenylethanoylamino)-N-(4-ethanoylphenyl)-N-methyl-pentanamide Openeye Name: N-(4-acetylphenyl)-2-[(2,2-diphenylacetyl)amino]-5-guanidino-N-methyl-pentanamide CAS Name: N-(4-acetylphenyl)-5-(diaminomethylideneamino)-N-methyl-2-[(1-oxo-2,2-diphenylethyl)amino]pentanamide IUPAC Name: N-(4-acetylphenyl)-5-(diaminomethylideneamino)-2-[(2,2-diphenylacetyl)amino]-N-methylpentanamide Traditional Name: N-(4-acetylphenyl)-2-[(2,2-diphenylacetyl)amino]-5-guanidino-N-methyl-valeramide Formula: C29H33N5O3 MolecularWeight: 499.60402

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N(C)C(=O)C(CCCN=C(N)N)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N(C)C(=O)C(CCCN=C(N)N)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C29H33N5O3/c1-20(35)21-15-17-24(18-16-21)34(2)28(37)25(14-9-19-32-29(30)31)33-27(36)26(22-10-5-3-6-11-22)23-12-7-4-8-13-23/h3-8,10-13,15-18,25-26H,9,14,19H2,1-2H3,(H,33,36)(H4,30,31,32)