5-methylsulfanyl-4-propan-2-ylsulfonyl-N-prop-2-ynyl-thiophene-2-carboxamide

Systemtic Name: 5-methylsulfanyl-4-propan-2-ylsulfonyl-N-prop-2-ynyl-thiophene-2-carboxamide Openeye Name: 4-isopropylsulfonyl-5-methylsulfanyl-N-prop-2-ynyl-thiophene-2-carboxamide CAS Name: 5-(methylthio)-4-propan-2-ylsulfonyl-N-prop-2-ynyl-2-thiophenecarboxamide IUPAC Name: 5-methylsulfanyl-4-propan-2-ylsulfonyl-N-prop-2-ynylthiophene-2-carboxamide Traditional Name: 4-isopropylsulfonyl-5-(methylthio)-N-propargyl-thiophene-2-carboxamide Formula: C12H15NO3S3 MolecularWeight: 317.4474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(SC(=C1)C(=O)NCC#C)SC

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(SC(=C1)C(=O)NCC#C)SC

InChI

InChI=1S/C12H15NO3S3/c1-5-6-13-11(14)9-7-10(12(17-4)18-9)19(15,16)8(2)3/h1,7-8H,6H2,2-4H3,(H,13,14)