1-[1-(2-chlorophenyl)-2-oxidanylidene-cyclohexyl]-1-methyl-3-prop-2-enyl-thiourea

Systemtic Name: 1-[1-(2-chlorophenyl)-2-oxidanylidene-cyclohexyl]-1-methyl-3-prop-2-enyl-thiourea Openeye Name: 3-allyl-1-[1-(2-chlorophenyl)-2-oxo-cyclohexyl]-1-methyl-thiourea CAS Name: 1-[1-(2-chlorophenyl)-2-oxocyclohexyl]-1-methyl-3-prop-2-enylthiourea IUPAC Name: 1-[1-(2-chlorophenyl)-2-oxocyclohexyl]-1-methyl-3-prop-2-enylthiourea Traditional Name: 3-allyl-1-[1-(2-chlorophenyl)-2-keto-cyclohexyl]-1-methyl-thiourea Formula: C17H21ClN2OS MolecularWeight: 336.87944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCC=C)C1(CCCCC1=O)C2=CC=CC=C2Cl

Isomeric SMILES

CN(C(=S)NCC=C)C1(CCCCC1=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C17H21ClN2OS/c1-3-12-19-16(22)20(2)17(11-7-6-10-15(17)21)13-8-4-5-9-14(13)18/h3-5,8-9H,1,6-7,10-12H2,2H3,(H,19,22)