2-methyl-N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-nitro-benzamide

Systemtic Name: 2-methyl-N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-nitro-benzamide Openeye Name: 2-methyl-3-nitro-N-[[4-(p-tolyl)thiazol-2-yl]carbamothioyl]benzamide CAS Name: 2-methyl-N-[[[4-(4-methylphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 2-methyl-N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-nitrobenzamide Traditional Name: 2-methyl-3-nitro-N-[[4-(p-tolyl)thiazol-2-yl]thiocarbamoyl]benzamide Formula: C19H16N4O3S2 MolecularWeight: 412.48534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H16N4O3S2/c1-11-6-8-13(9-7-11)15-10-28-19(20-15)22-18(27)21-17(24)14-4-3-5-16(12(14)2)23(25)26/h3-10H,1-2H3,(H2,20,21,22,24,27)