methyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzenecarbodithioate

Systemtic Name: methyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzenecarbodithioate Openeye Name: methyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzenecarbodithioate CAS Name: 4-phenoxy-3-(1-pyrrolidinyl)-5-sulfamoylbenzenecarbodithioic acid methyl ester IUPAC Name: methyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoylbenzenecarbodithioate Traditional Name: 4-phenoxy-3-pyrrolidino-5-sulfamoyl-benzenecarbodithioic acid methyl ester Formula: C18H20N2O3S3 MolecularWeight: 408.558

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=S)C1=CC(=C(C(=C1)S(=O)(=O)N)OC2=CC=CC=C2)N3CCCC3

Isomeric SMILES

CSC(=S)C1=CC(=C(C(=C1)S(=O)(=O)N)OC2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C18H20N2O3S3/c1-25-18(24)13-11-15(20-9-5-6-10-20)17(16(12-13)26(19,21)22)23-14-7-3-2-4-8-14/h2-4,7-8,11-12H,5-6,9-10H2,1H3,(H2,19,21,22)