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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)NC(=S)NCC3=CC=CC=C3)N4CCCC4

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)NC(=S)NCC3=CC=CC=C3)N4CCCC4

InChI

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