1-(3-chloranyl-2-methyl-phenyl)-3-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-(2-methoxy-5-piperidinosulfonyl-phenyl)thiourea Formula: C20H24ClN3O3S2 MolecularWeight: 454.00586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC

InChI

InChI=1S/C20H24ClN3O3S2/c1-14-16(21)7-6-8-17(14)22-20(28)23-18-13-15(9-10-19(18)27-2)29(25,26)24-11-4-3-5-12-24/h6-10,13H,3-5,11-12H2,1-2H3,(H2,22,23,28)