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

Systemtic Name: 1-cyclopropyl-3-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]thiourea Openeye Name: 1-cyclopropyl-3-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]thiourea CAS Name: 1-cyclopropyl-3-[3-[(4-methoxyphenyl)sulfamoyl]-4-(1-pyrrolidinyl)phenyl]thiourea IUPAC Name: 1-cyclopropyl-3-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-ylphenyl]thiourea Traditional Name: 1-cyclopropyl-3-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidino-phenyl]thiourea Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)NC(=S)NC3CC3)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)NC(=S)NC3CC3)N4CCCC4

InChI

InChI=1S/C21H26N4O3S2/c1-28-18-9-6-16(7-10-18)24-30(26,27)20-14-17(23-21(29)22-15-4-5-15)8-11-19(20)25-12-2-3-13-25/h6-11,14-15,24H,2-5,12-13H2,1H3,(H2,22,23,29)