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

Systemtic Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-yl-phenyl]thiourea CAS Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-(1-pyrrolidinyl)phenyl]-3-prop-2-enylthiourea IUPAC Name: 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-ylphenyl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[5-[(4-methoxyphenyl)sulfamoyl]-2-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=CC(=C(C=C2)N3CCCC3)NC(=S)NCC=C

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O3S2/c1-3-12-22-21(29)23-19-15-18(10-11-20(19)25-13-4-5-14-25)30(26,27)24-16-6-8-17(28-2)9-7-16/h3,6-11,15,24H,1,4-5,12-14H2,2H3,(H2,22,23,29)