N-methyl-N-[2-[(3-nitro-4-thiomorpholin-4-yl-phenyl)amino]-2-oxidanylidene-ethyl]-4-phenyl-benzamide

Systemtic Name: N-methyl-N-[2-[(3-nitro-4-thiomorpholin-4-yl-phenyl)amino]-2-oxidanylidene-ethyl]-4-phenyl-benzamide Openeye Name: N-methyl-N-[2-(3-nitro-4-thiomorpholino-anilino)-2-oxo-ethyl]-4-phenyl-benzamide CAS Name: N-methyl-N-[2-(3-nitro-4-thiomorpholin-4-ylanilino)-2-oxoethyl]-4-phenylbenzamide IUPAC Name: N-methyl-N-[2-(3-nitro-4-thiomorpholin-4-ylanilino)-2-oxoethyl]-4-phenylbenzamide Traditional Name: N-[2-keto-2-(3-nitro-4-thiomorpholino-anilino)ethyl]-N-methyl-4-phenyl-benzamide Formula: C26H26N4O4S MolecularWeight: 490.57404

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=C(C=C1)N2CCSCC2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CN(CC(=O)NC1=CC(=C(C=C1)N2CCSCC2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H26N4O4S/c1-28(26(32)21-9-7-20(8-10-21)19-5-3-2-4-6-19)18-25(31)27-22-11-12-23(24(17-22)30(33)34)29-13-15-35-16-14-29/h2-12,17H,13-16,18H2,1H3,(H,27,31)