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

Systemtic Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]thiourea CAS Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-(1-pyrrolidinyl)phenyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-ylphenyl]thiourea Traditional Name: 1-benzyl-3-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidino-phenyl]thiourea Formula: C25H28N4O3S2 MolecularWeight: 496.64482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)NC(=S)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)NC(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O3S2/c1-32-21-11-9-20(10-12-21)28-34(30,31)22-13-14-24(29-15-5-6-16-29)23(17-22)27-25(33)26-18-19-7-3-2-4-8-19/h2-4,7-14,17,28H,5-6,15-16,18H2,1H3,(H2,26,27,33)