N-cyclopropyl-4-methyl-N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-cyclopropyl-4-methyl-N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-N-cyclopropyl-4-methyl-3-nitro-benzamide CAS Name: N-cyclopropyl-4-methyl-N-[2-[(5-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-cyclopropyl-4-methyl-3-nitrobenzamide Traditional Name: N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-N-cyclopropyl-4-methyl-3-nitro-benzamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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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=C(S3)C)C4CC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC(=O)N(CC2=CC=CC=C2)CC3=CC=C(S3)C)C4CC4)[N+](=O)[O-]

InChI

InChI=1S/C26H27N3O4S/c1-18-8-10-21(14-24(18)29(32)33)26(31)28(22-11-12-22)17-25(30)27(15-20-6-4-3-5-7-20)16-23-13-9-19(2)34-23/h3-10,13-14,22H,11-12,15-17H2,1-2H3