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

Systemtic Name: 1-[1-(2-chlorophenyl)-2-oxidanylidene-cyclohexyl]-3-[(4-methoxyphenyl)methyl]-1-methyl-thiourea Openeye Name: 1-[1-(2-chlorophenyl)-2-oxo-cyclohexyl]-3-[(4-methoxyphenyl)methyl]-1-methyl-thiourea CAS Name: 1-[1-(2-chlorophenyl)-2-oxocyclohexyl]-3-[(4-methoxyphenyl)methyl]-1-methylthiourea IUPAC Name: 1-[1-(2-chlorophenyl)-2-oxocyclohexyl]-3-[(4-methoxyphenyl)methyl]-1-methylthiourea Traditional Name: 1-[1-(2-chlorophenyl)-2-keto-cyclohexyl]-1-methyl-3-p-anisyl-thiourea Formula: C22H25ClN2O2S MolecularWeight: 416.9641

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCC1=CC=C(C=C1)OC)C2(CCCCC2=O)C3=CC=CC=C3Cl

Isomeric SMILES

CN(C(=S)NCC1=CC=C(C=C1)OC)C2(CCCCC2=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H25ClN2O2S/c1-25(21(28)24-15-16-10-12-17(27-2)13-11-16)22(14-6-5-9-20(22)26)18-7-3-4-8-19(18)23/h3-4,7-8,10-13H,5-6,9,14-15H2,1-2H3,(H,24,28)