4-[2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: 4-[2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 3-nitro-4-[2-oxo-2-[[4-(p-tolyl)thiazol-2-yl]amino]ethyl]sulfanyl-benzamide CAS Name: 4-[[2-[[4-(4-methylphenyl)-2-thiazolyl]amino]-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-keto-2-[[4-(p-tolyl)thiazol-2-yl]amino]ethyl]thio]-3-nitro-benzamide Formula: C19H16N4O4S2 MolecularWeight: 428.48474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O4S2/c1-11-2-4-12(5-3-11)14-9-29-19(21-14)22-17(24)10-28-16-7-6-13(18(20)25)8-15(16)23(26)27/h2-9H,10H2,1H3,(H2,20,25)(H,21,22,24)