3-[2-(2-aminophenyl)ethanoyl]-3-azanyl-5-(1H-indol-3-yl)-4-oxidanylidene-pentanamide

Systemtic Name: 3-[2-(2-aminophenyl)ethanoyl]-3-azanyl-5-(1H-indol-3-yl)-4-oxidanylidene-pentanamide Openeye Name: 3-amino-3-[2-(2-aminophenyl)acetyl]-5-(1H-indol-3-yl)-4-oxo-pentanamide CAS Name: 3-amino-3-[2-(2-aminophenyl)-1-oxoethyl]-5-(1H-indol-3-yl)-4-oxopentanamide IUPAC Name: 3-amino-3-[2-(2-aminophenyl)acetyl]-5-(1H-indol-3-yl)-4-oxopentanamide Traditional Name: 3-amino-3-[2-(2-aminophenyl)acetyl]-5-(1H-indol-3-yl)-4-keto-valeramide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)C(CC(=O)N)(C(=O)CC2=CNC3=CC=CC=C32)N)N

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)C(CC(=O)N)(C(=O)CC2=CNC3=CC=CC=C32)N)N

InChI

InChI=1S/C21H22N4O3/c22-16-7-3-1-5-13(16)9-18(26)21(24,11-20(23)28)19(27)10-14-12-25-17-8-4-2-6-15(14)17/h1-8,12,25H,9-11,22,24H2,(H2,23,28)