5,6,7,7a-tetrahydro-4H-thieno[3,2-c]pyridin-2-one; 4-methylbenzenesulfonic acid

Systemtic Name: 5,6,7,7a-tetrahydro-4H-thieno[3,2-c]pyridin-2-one; 4-methylbenzenesulfonic acid Openeye Name: 5,6,7,7a-tetrahydro-4H-thieno[3,2-c]pyridin-2-one; 4-methylbenzenesulfonic acid CAS Name: 5,6,7,7a-tetrahydro-4H-thieno[3,2-c]pyridin-2-one; 4-methylbenzenesulfonic acid IUPAC Name: 5,6,7,7a-tetrahydro-4H-thieno[3,2-c]pyridin-2-one; 4-methylbenzenesulfonic acid Traditional Name: 5,6,7,7a-tetrahydro-4H-thieno[3,2-c]pyridin-2-one; tosylic acid Formula: C14H17NO4S2 MolecularWeight: 327.41908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1CNCC2=CC(=O)SC21

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1CNCC2=CC(=O)SC21

InChI

InChI=1S/C7H9NOS.C7H8O3S/c9-7-3-5-4-8-2-1-6(5)10-7;1-6-2-4-7(5-3-6)11(8,9)10/h3,6,8H,1-2,4H2;2-5H,1H3,(H,8,9,10)