1-(3,5-dimethylphenyl)-3-[2-methoxy-5-(phenylsulfonyl)phenyl]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[2-methoxy-5-(phenylsulfonyl)phenyl]thiourea Openeye Name: 1-[5-(benzenesulfonyl)-2-methoxy-phenyl]-3-(3,5-dimethylphenyl)thiourea CAS Name: 1-[5-(benzenesulfonyl)-2-methoxyphenyl]-3-(3,5-dimethylphenyl)thiourea IUPAC Name: 1-[5-(benzenesulfonyl)-2-methoxyphenyl]-3-(3,5-dimethylphenyl)thiourea Traditional Name: 1-(5-besyl-2-methoxy-phenyl)-3-(3,5-dimethylphenyl)thiourea Formula: C22H22N2O3S2 MolecularWeight: 426.55168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)OC)C

InChI

InChI=1S/C22H22N2O3S2/c1-15-11-16(2)13-17(12-15)23-22(28)24-20-14-19(9-10-21(20)27-3)29(25,26)18-7-5-4-6-8-18/h4-14H,1-3H3,(H2,23,24,28)