N-(4-chloranyl-2-methyl-phenyl)-2-(furan-2-ylmethylamino)-4-(4-methylphenyl)-6-oxidanylidene-cyclohexene-1-carbothioamide

Systemtic Name: N-(4-chloranyl-2-methyl-phenyl)-2-(furan-2-ylmethylamino)-4-(4-methylphenyl)-6-oxidanylidene-cyclohexene-1-carbothioamide Openeye Name: N-(4-chloro-2-methyl-phenyl)-2-(2-furylmethylamino)-6-oxo-4-(p-tolyl)cyclohexene-1-carbothioamide CAS Name: N-(4-chloro-2-methylphenyl)-2-(2-furanylmethylamino)-4-(4-methylphenyl)-6-oxo-1-cyclohexenecarbothioamide IUPAC Name: N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)-4-(4-methylphenyl)-6-oxocyclohexene-1-carbothioamide Traditional Name: N-(4-chloro-2-methyl-phenyl)-2-(2-furfurylamino)-6-keto-4-(p-tolyl)cyclohexene-1-carbothioamide Formula: C26H25ClN2O2S MolecularWeight: 465.0069

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=C(C(=O)C2)C(=S)NC3=C(C=C(C=C3)Cl)C)NCC4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=C(C(=O)C2)C(=S)NC3=C(C=C(C=C3)Cl)C)NCC4=CC=CO4

InChI

InChI=1S/C26H25ClN2O2S/c1-16-5-7-18(8-6-16)19-13-23(28-15-21-4-3-11-31-21)25(24(30)14-19)26(32)29-22-10-9-20(27)12-17(22)2/h3-12,19,28H,13-15H2,1-2H3,(H,29,32)