4-(pentan-3-ylsulfamoylmethyl)benzenecarbothioamide

Systemtic Name: 4-(pentan-3-ylsulfamoylmethyl)benzenecarbothioamide Openeye Name: 4-(1-ethylpropylsulfamoylmethyl)benzenecarbothioamide CAS Name: 4-(pentan-3-ylsulfamoylmethyl)benzenecarbothioamide IUPAC Name: 4-(pentan-3-ylsulfamoylmethyl)benzenecarbothioamide Traditional Name: 4-(1-ethylpropylsulfamoylmethyl)thiobenzamide Formula: C13H20N2O2S2 MolecularWeight: 300.4401

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NS(=O)(=O)CC1=CC=C(C=C1)C(=S)N

Isomeric SMILES

CCC(CC)NS(=O)(=O)CC1=CC=C(C=C1)C(=S)N

InChI

InChI=1S/C13H20N2O2S2/c1-3-12(4-2)15-19(16,17)9-10-5-7-11(8-6-10)13(14)18/h5-8,12,15H,3-4,9H2,1-2H3,(H2,14,18)