4-methoxy-N-[[2-(4-methylphenyl)benzotriazol-5-yl]sulfanylcarbamoyl]-3-nitro-benzamide

Systemtic Name: 4-methoxy-N-[[2-(4-methylphenyl)benzotriazol-5-yl]sulfanylcarbamoyl]-3-nitro-benzamide Openeye Name: 4-methoxy-3-nitro-N-[[2-(p-tolyl)benzotriazol-5-yl]sulfanylcarbamoyl]benzamide CAS Name: 4-methoxy-N-[[[[2-(4-methylphenyl)-5-benzotriazolyl]thio]amino]-oxomethyl]-3-nitrobenzamide IUPAC Name: 4-methoxy-N-[[2-(4-methylphenyl)benzotriazol-5-yl]sulfanylcarbamoyl]-3-nitrobenzamide Traditional Name: 4-methoxy-3-nitro-N-[[[2-(p-tolyl)benzotriazol-5-yl]thio]carbamoyl]benzamide Formula: C22H18N6O5S MolecularWeight: 478.48052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)SNC(=O)NC(=O)C4=CC(=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)SNC(=O)NC(=O)C4=CC(=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H18N6O5S/c1-13-3-6-15(7-4-13)27-24-17-9-8-16(12-18(17)25-27)34-26-22(30)23-21(29)14-5-10-20(33-2)19(11-14)28(31)32/h3-12H,1-2H3,(H2,23,26,29,30)