N-cyclopropyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-cyclopropyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-cyclopropyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(2-thienylmethyl)amino]-2-oxo-ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-cyclopropyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-cyclopropyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-cyclopropyl-N-[2-[homoveratryl(2-thenyl)amino]-2-keto-ethyl]-4-methyl-3-nitro-benzamide Formula: C28H31N3O6S MolecularWeight: 537.62724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CC(=O)N(CCC2=CC(=C(C=C2)OC)OC)CC3=CC=CS3)C4CC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC(=O)N(CCC2=CC(=C(C=C2)OC)OC)CC3=CC=CS3)C4CC4)[N+](=O)[O-]

InChI

InChI=1S/C28H31N3O6S/c1-19-6-8-21(16-24(19)31(34)35)28(33)30(22-9-10-22)18-27(32)29(17-23-5-4-14-38-23)13-12-20-7-11-25(36-2)26(15-20)37-3/h4-8,11,14-16,22H,9-10,12-13,17-18H2,1-3H3