N-cyclohexyl-4-methyl-3-nitro-N-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]benzamide

Systemtic Name: N-cyclohexyl-4-methyl-3-nitro-N-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]benzamide Openeye Name: N-[2-[benzyl(2-thienylmethyl)amino]-2-oxo-ethyl]-N-cyclohexyl-4-methyl-3-nitro-benzamide CAS Name: N-cyclohexyl-4-methyl-3-nitro-N-[2-oxo-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]benzamide IUPAC Name: N-[2-[benzyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-cyclohexyl-4-methyl-3-nitrobenzamide Traditional Name: N-[2-[benzyl(2-thenyl)amino]-2-keto-ethyl]-N-cyclohexyl-4-methyl-3-nitro-benzamide Formula: C28H31N3O4S MolecularWeight: 505.62844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3)C4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3)C4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C28H31N3O4S/c1-21-14-15-23(17-26(21)31(34)35)28(33)30(24-11-6-3-7-12-24)20-27(32)29(19-25-13-8-16-36-25)18-22-9-4-2-5-10-22/h2,4-5,8-10,13-17,24H,3,6-7,11-12,18-20H2,1H3