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

Systemtic Name: 4-[2-[[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 3-nitro-4-[2-oxo-2-[[3-(p-tolylmethyl)thiazol-2-ylidene]amino]ethyl]sulfanyl-benzamide CAS Name: 4-[[2-[[3-[(4-methylphenyl)methyl]-2-thiazolylidene]amino]-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-[[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]amino]-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-keto-2-[[3-(4-methylbenzyl)-4-thiazolin-2-ylidene]amino]ethyl]thio]-3-nitro-benzamide Formula: C20H18N4O4S2 MolecularWeight: 442.51132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=CSC2=NC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=CSC2=NC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O4S2/c1-13-2-4-14(5-3-13)11-23-8-9-29-20(23)22-18(25)12-30-17-7-6-15(19(21)26)10-16(17)24(27)28/h2-10H,11-12H2,1H3,(H2,21,26)