2-pyrrolidin-1-ylethyl 2-benzamido-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: 2-pyrrolidin-1-ylethyl 2-benzamido-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: 2-pyrrolidin-1-ylethyl 2-benzamido-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 2-benzamido-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid 2-(1-pyrrolidinyl)ethyl ester IUPAC Name: 2-pyrrolidin-1-ylethyl 2-benzamido-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 2-benzamido-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid 2-pyrrolidinoethyl ester Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC(=O)N2CCC3=C(C2)SC(=C3C#N)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)CCOC(=O)N2CCC3=C(C2)SC(=C3C#N)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S/c23-14-18-17-8-11-26(22(28)29-13-12-25-9-4-5-10-25)15-19(17)30-21(18)24-20(27)16-6-2-1-3-7-16/h1-3,6-7H,4-5,8-13,15H2,(H,24,27)