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

Systemtic Name: 1-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[3-[(4-methoxyphenyl)sulfamoyl]-4-(1-pyrrolidinyl)phenyl]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-ylphenyl]-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidino-phenyl]-3-[3-(methylthio)propyl]thiourea Formula: C22H30N4O3S3 MolecularWeight: 494.6936

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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)NCCCSC)N3CCCC3

Isomeric SMILES

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

InChI

InChI=1S/C22H30N4O3S3/c1-29-19-9-6-17(7-10-19)25-32(27,28)21-16-18(24-22(30)23-12-5-15-31-2)8-11-20(21)26-13-3-4-14-26/h6-11,16,25H,3-5,12-15H2,1-2H3,(H2,23,24,30)