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

Systemtic Name: N-butyl-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-butyl-4-methyl-3-nitro-benzamide CAS Name: N-butyl-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-butyl-4-methyl-3-nitrobenzamide Traditional Name: N-[2-[benzyl(2-thenyl)amino]-2-keto-ethyl]-N-butyl-4-methyl-3-nitro-benzamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C26H29N3O4S/c1-3-4-14-27(26(31)22-13-12-20(2)24(16-22)29(32)33)19-25(30)28(18-23-11-8-15-34-23)17-21-9-6-5-7-10-21/h5-13,15-16H,3-4,14,17-19H2,1-2H3