N-[4-(cyanomethyl)phenyl]-5-methylsulfanyl-N-propan-2-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-5-methylsulfanyl-N-propan-2-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-[4-(cyanomethyl)phenyl]-N-isopropylsulfonyl-5-methylsulfanyl-thiophene-2-carboxamide CAS Name: N-[4-(cyanomethyl)phenyl]-5-(methylthio)-N-propan-2-ylsulfonyl-2-thiophenecarboxamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-5-methylsulfanyl-N-propan-2-ylsulfonylthiophene-2-carboxamide Traditional Name: N-[4-(cyanomethyl)phenyl]-N-isopropylsulfonyl-5-(methylthio)thiophene-2-carboxamide Formula: C17H18N2O3S3 MolecularWeight: 394.53142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N(C1=CC=C(C=C1)CC#N)C(=O)C2=CC=C(S2)SC

Isomeric SMILES

CC(C)S(=O)(=O)N(C1=CC=C(C=C1)CC#N)C(=O)C2=CC=C(S2)SC

InChI

InChI=1S/C17H18N2O3S3/c1-12(2)25(21,22)19(14-6-4-13(5-7-14)10-11-18)17(20)15-8-9-16(23-3)24-15/h4-9,12H,10H2,1-3H3