3-(3-chloranyl-4-methyl-phenyl)-1-[1-(2-chlorophenyl)-2-oxidanylidene-cyclohexyl]-1-methyl-thiourea

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-1-[1-(2-chlorophenyl)-2-oxidanylidene-cyclohexyl]-1-methyl-thiourea Openeye Name: 3-(3-chloro-4-methyl-phenyl)-1-[1-(2-chlorophenyl)-2-oxo-cyclohexyl]-1-methyl-thiourea CAS Name: 3-(3-chloro-4-methylphenyl)-1-[1-(2-chlorophenyl)-2-oxocyclohexyl]-1-methylthiourea IUPAC Name: 3-(3-chloro-4-methylphenyl)-1-[1-(2-chlorophenyl)-2-oxocyclohexyl]-1-methylthiourea Traditional Name: 3-(3-chloro-4-methyl-phenyl)-1-[1-(2-chlorophenyl)-2-keto-cyclohexyl]-1-methyl-thiourea Formula: C21H22Cl2N2OS MolecularWeight: 421.38318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(C)C2(CCCCC2=O)C3=CC=CC=C3Cl)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(C)C2(CCCCC2=O)C3=CC=CC=C3Cl)Cl

InChI

InChI=1S/C21H22Cl2N2OS/c1-14-10-11-15(13-18(14)23)24-20(27)25(2)21(12-6-5-9-19(21)26)16-7-3-4-8-17(16)22/h3-4,7-8,10-11,13H,5-6,9,12H2,1-2H3,(H,24,27)