methyl 6-[(E)-4-methylpent-2-enoyl]-2-pyrrolidin-1-ylsulfonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 6-[(E)-4-methylpent-2-enoyl]-2-pyrrolidin-1-ylsulfonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 6-[(E)-4-methylpent-2-enoyl]-2-pyrrolidin-1-ylsulfonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 6-[(E)-4-methyl-1-oxopent-2-enyl]-2-(1-pyrrolidinylsulfonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-[(E)-4-methylpent-2-enoyl]-2-pyrrolidin-1-ylsulfonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 6-[(E)-4-methylpent-2-enoyl]-2-pyrrolidinosulfonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C19H26N2O5S2 MolecularWeight: 426.55014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=CC(=O)N1CCC2=C(C1)SC(=C2C(=O)OC)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)/C=C/C(=O)N1CCC2=C(C1)SC(=C2C(=O)OC)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H26N2O5S2/c1-13(2)6-7-16(22)20-11-8-14-15(12-20)27-19(17(14)18(23)26-3)28(24,25)21-9-4-5-10-21/h6-7,13H,4-5,8-12H2,1-3H3/b7-6+