1-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[5-(diethylsulfamoyl)-2-pyrrolidin-1-ylphenyl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[5-(diethylsulfamoyl)-2-pyrrolidino-phenyl]-3-(4-methoxyphenyl)thiourea Formula: C22H30N4O3S2 MolecularWeight: 462.6286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=S)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=S)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H30N4O3S2/c1-4-26(5-2)31(27,28)19-12-13-21(25-14-6-7-15-25)20(16-19)24-22(30)23-17-8-10-18(29-3)11-9-17/h8-13,16H,4-7,14-15H2,1-3H3,(H2,23,24,30)