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

Systemtic Name: 1-[1-(2-chlorophenyl)-2-oxidanylidene-cyclohexyl]-1-methyl-3-(2-nitrophenyl)thiourea Openeye Name: 1-[1-(2-chlorophenyl)-2-oxo-cyclohexyl]-1-methyl-3-(2-nitrophenyl)thiourea CAS Name: 1-[1-(2-chlorophenyl)-2-oxocyclohexyl]-1-methyl-3-(2-nitrophenyl)thiourea IUPAC Name: 1-[1-(2-chlorophenyl)-2-oxocyclohexyl]-1-methyl-3-(2-nitrophenyl)thiourea Traditional Name: 1-[1-(2-chlorophenyl)-2-keto-cyclohexyl]-1-methyl-3-(2-nitrophenyl)thiourea Formula: C20H20ClN3O3S MolecularWeight: 417.9091

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NC1=CC=CC=C1[N+](=O)[O-])C2(CCCCC2=O)C3=CC=CC=C3Cl

Isomeric SMILES

CN(C(=S)NC1=CC=CC=C1[N+](=O)[O-])C2(CCCCC2=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H20ClN3O3S/c1-23(19(28)22-16-10-4-5-11-17(16)24(26)27)20(13-7-6-12-18(20)25)14-8-2-3-9-15(14)21/h2-5,8-11H,6-7,12-13H2,1H3,(H,22,28)