3-carbamimidoyl-N-[2-[(2-methylcyclohexyl)amino]-2-oxidanylidene-ethyl]-N-naphthalen-1-yl-benzamide

Systemtic Name: 3-carbamimidoyl-N-[2-[(2-methylcyclohexyl)amino]-2-oxidanylidene-ethyl]-N-naphthalen-1-yl-benzamide Openeye Name: 3-carbamimidoyl-N-[2-[(2-methylcyclohexyl)amino]-2-oxo-ethyl]-N-(1-naphthyl)benzamide CAS Name: 3-carbamimidoyl-N-[2-[(2-methylcyclohexyl)amino]-2-oxoethyl]-N-(1-naphthalenyl)benzamide IUPAC Name: 3-carbamimidoyl-N-[2-[(2-methylcyclohexyl)amino]-2-oxoethyl]-N-naphthalen-1-ylbenzamide Traditional Name: 3-amidino-N-[2-keto-2-[(2-methylcyclohexyl)amino]ethyl]-N-(1-naphthyl)benzamide Formula: C27H30N4O2 MolecularWeight: 442.5527

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CN(C2=CC=CC3=CC=CC=C32)C(=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CC1CCCCC1NC(=O)CN(C2=CC=CC3=CC=CC=C32)C(=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C27H30N4O2/c1-18-8-2-5-14-23(18)30-25(32)17-31(24-15-7-10-19-9-3-4-13-22(19)24)27(33)21-12-6-11-20(16-21)26(28)29/h3-4,6-7,9-13,15-16,18,23H,2,5,8,14,17H2,1H3,(H3,28,29)(H,30,32)