4-[2-[3-(azepan-1-yl)propylamino]-2-oxidanylidene-ethyl]-3-oxidanylidene-N-(phenylmethyl)-2H-quinoxaline-1-carboxamide

Systemtic Name: 4-[2-[3-(azepan-1-yl)propylamino]-2-oxidanylidene-ethyl]-3-oxidanylidene-N-(phenylmethyl)-2H-quinoxaline-1-carboxamide Openeye Name: 4-[2-[3-(azepan-1-yl)propylamino]-2-oxo-ethyl]-N-benzyl-3-oxo-2H-quinoxaline-1-carboxamide CAS Name: 4-[2-[3-(1-azepanyl)propylamino]-2-oxoethyl]-3-oxo-N-(phenylmethyl)-2H-quinoxaline-1-carboxamide IUPAC Name: 4-[2-[3-(azepan-1-yl)propylamino]-2-oxoethyl]-N-benzyl-3-oxo-2H-quinoxaline-1-carboxamide Traditional Name: 4-[2-[3-(azepan-1-yl)propylamino]-2-keto-ethyl]-N-benzyl-3-keto-2H-quinoxaline-1-carboxamide Formula: C27H35N5O3 MolecularWeight: 477.5985

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCNC(=O)CN2C(=O)CN(C3=CC=CC=C32)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)CCCNC(=O)CN2C(=O)CN(C3=CC=CC=C32)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H35N5O3/c33-25(28-15-10-18-30-16-8-1-2-9-17-30)20-31-23-13-6-7-14-24(23)32(21-26(31)34)27(35)29-19-22-11-4-3-5-12-22/h3-7,11-14H,1-2,8-10,15-21H2,(H,28,33)(H,29,35)