1-(2-chlorophenyl)-3-(4-methoxy-2-piperidin-1-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-(2-chlorophenyl)-3-(4-methoxy-2-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(2-chlorophenyl)-3-[4-methoxy-2-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-(2-chlorophenyl)-3-[4-methoxy-2-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(2-chlorophenyl)-3-(4-methoxy-2-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(2-chlorophenyl)-3-(4-methoxy-2-piperidinosulfonyl-phenyl)thiourea Formula: C19H22ClN3O3S2 MolecularWeight: 439.97928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=S)NC2=CC=CC=C2Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=S)NC2=CC=CC=C2Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H22ClN3O3S2/c1-26-14-9-10-17(22-19(27)21-16-8-4-3-7-15(16)20)18(13-14)28(24,25)23-11-5-2-6-12-23/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H2,21,22,27)