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

Systemtic Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]-3-methyl-thiourea Openeye Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]-3-methyl-thiourea CAS Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-(1-pyrrolidinyl)phenyl]-3-methylthiourea IUPAC Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-ylphenyl]-3-methylthiourea Traditional Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidino-phenyl]-3-methyl-thiourea Formula: C19H24N4O3S2 MolecularWeight: 420.54886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N4O3S2/c1-20-19(27)21-17-13-16(9-10-18(17)23-11-3-4-12-23)28(24,25)22-14-5-7-15(26-2)8-6-14/h5-10,13,22H,3-4,11-12H2,1-2H3,(H2,20,21,27)