3-(4-chloranyl-3-nitro-phenyl)-N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]prop-2-enamide

Systemtic Name: 3-(4-chloranyl-3-nitro-phenyl)-N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]prop-2-enamide Openeye Name: 3-(4-chloro-3-nitro-phenyl)-N-[[4-(4-methoxyphenyl)thiazol-2-yl]carbamothioyl]prop-2-enamide CAS Name: 3-(4-chloro-3-nitrophenyl)-N-[[[4-(4-methoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-(4-chloro-3-nitrophenyl)-N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]prop-2-enamide Traditional Name: 3-(4-chloro-3-nitro-phenyl)-N-[[4-(4-methoxyphenyl)thiazol-2-yl]thiocarbamoyl]acrylamide Formula: C20H15ClN4O4S2 MolecularWeight: 474.9405

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H15ClN4O4S2/c1-29-14-6-4-13(5-7-14)16-11-31-20(22-16)24-19(30)23-18(26)9-3-12-2-8-15(21)17(10-12)25(27)28/h2-11H,1H3,(H2,22,23,24,26,30)