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

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

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

Isomeric SMILES

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

InChI

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