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

Systemtic Name: N-butyl-4-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-nitro-benzamide CAS Name: N-butyl-4-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-nitrobenzamide Traditional Name: N-[2-[benzyl(2-thenyl)amino]-2-keto-ethyl]-N-butyl-4-nitro-benzamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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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)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O4S/c1-2-3-15-26(25(30)21-11-13-22(14-12-21)28(31)32)19-24(29)27(18-23-10-7-16-33-23)17-20-8-5-4-6-9-20/h4-14,16H,2-3,15,17-19H2,1H3