2-[2-(1,3-benzothiazol-2-yl)-1-[(3-chloranyl-2-methyl-phenyl)amino]-2-cyano-ethenyl]sulfanyl-N-cyclohexyl-N-methyl-ethanamide

Systemtic Name: 2-[2-(1,3-benzothiazol-2-yl)-1-[(3-chloranyl-2-methyl-phenyl)amino]-2-cyano-ethenyl]sulfanyl-N-cyclohexyl-N-methyl-ethanamide Openeye Name: 2-[2-(1,3-benzothiazol-2-yl)-1-(3-chloro-2-methyl-anilino)-2-cyano-vinyl]sulfanyl-N-cyclohexyl-N-methyl-acetamide CAS Name: 2-[[2-(1,3-benzothiazol-2-yl)-1-(3-chloro-2-methylanilino)-2-cyanoethenyl]thio]-N-cyclohexyl-N-methylacetamide IUPAC Name: 2-[2-(1,3-benzothiazol-2-yl)-1-(3-chloro-2-methylanilino)-2-cyanoethenyl]sulfanyl-N-cyclohexyl-N-methylacetamide Traditional Name: 2-[[2-(1,3-benzothiazol-2-yl)-1-(3-chloro-2-methyl-anilino)-2-cyano-vinyl]thio]-N-cyclohexyl-N-methyl-acetamide Formula: C26H27ClN4OS2 MolecularWeight: 511.10178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=C(C#N)C2=NC3=CC=CC=C3S2)SCC(=O)N(C)C4CCCCC4

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=C(C#N)C2=NC3=CC=CC=C3S2)SCC(=O)N(C)C4CCCCC4

InChI

InChI=1S/C26H27ClN4OS2/c1-17-20(27)11-8-13-21(17)29-25(33-16-24(32)31(2)18-9-4-3-5-10-18)19(15-28)26-30-22-12-6-7-14-23(22)34-26/h6-8,11-14,18,29H,3-5,9-10,16H2,1-2H3