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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)OC)N3CCCC3

Isomeric SMILES

CCCCNC(=S)NC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)OC)N3CCCC3

InChI

InChI=1S/C22H30N4O3S2/c1-3-4-13-23-22(30)24-20-16-19(11-12-21(20)26-14-5-6-15-26)31(27,28)25-17-7-9-18(29-2)10-8-17/h7-12,16,25H,3-6,13-15H2,1-2H3,(H2,23,24,30)