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

Systemtic Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]-3-phenethyl-thiourea Openeye Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]-3-phenethyl-thiourea CAS Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-(1-pyrrolidinyl)phenyl]-3-phenethylthiourea IUPAC Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-ylphenyl]-3-phenethylthiourea Traditional Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidino-phenyl]-3-phenethyl-thiourea Formula: C26H30N4O3S2 MolecularWeight: 510.6714

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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)NCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)NC(=S)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H30N4O3S2/c1-33-22-11-9-21(10-12-22)29-35(31,32)23-13-14-25(30-17-5-6-18-30)24(19-23)28-26(34)27-16-15-20-7-3-2-4-8-20/h2-4,7-14,19,29H,5-6,15-18H2,1H3,(H2,27,28,34)