N-[1-(2-aminophenyl)-6-azanyl-3-[2-(1H-indol-3-yl)ethanoyl]-2-oxidanylidene-hexan-3-yl]pyrazine-2-carboxamide

Systemtic Name: N-[1-(2-aminophenyl)-6-azanyl-3-[2-(1H-indol-3-yl)ethanoyl]-2-oxidanylidene-hexan-3-yl]pyrazine-2-carboxamide Openeye Name: N-[4-amino-1-[2-(2-aminophenyl)acetyl]-1-[2-(1H-indol-3-yl)acetyl]butyl]pyrazine-2-carboxamide CAS Name: N-[6-amino-1-(2-aminophenyl)-3-[2-(1H-indol-3-yl)-1-oxoethyl]-2-oxohexan-3-yl]-2-pyrazinecarboxamide IUPAC Name: N-[6-amino-1-(2-aminophenyl)-3-[2-(1H-indol-3-yl)acetyl]-2-oxohexan-3-yl]pyrazine-2-carboxamide Traditional Name: N-[4-amino-1-[2-(2-aminophenyl)acetyl]-1-[2-(1H-indol-3-yl)acetyl]butyl]pyrazinamide Formula: C27H28N6O3 MolecularWeight: 484.54962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)C(CCCN)(C(=O)CC2=CNC3=CC=CC=C32)NC(=O)C4=NC=CN=C4)N

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)C(CCCN)(C(=O)CC2=CNC3=CC=CC=C32)NC(=O)C4=NC=CN=C4)N

InChI

InChI=1S/C27H28N6O3/c28-11-5-10-27(33-26(36)23-17-30-12-13-31-23,24(34)14-18-6-1-3-8-21(18)29)25(35)15-19-16-32-22-9-4-2-7-20(19)22/h1-4,6-9,12-13,16-17,32H,5,10-11,14-15,28-29H2,(H,33,36)