ethyl 4-[(1-thieno[3,2-c]pyridin-4-ylpiperidin-4-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(1-thieno[3,2-c]pyridin-4-ylpiperidin-4-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carbonyl)amino]benzoate CAS Name: 4-[[oxo-[1-(4-thieno[3,2-c]pyridinyl)-4-piperidinyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carbonyl)amino]benzoate Traditional Name: 4-[(1-thieno[3,2-c]pyridin-4-ylisonipecotoyl)amino]benzoic acid ethyl ester Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=CC4=C3C=CS4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=CC4=C3C=CS4

InChI

InChI=1S/C22H23N3O3S/c1-2-28-22(27)16-3-5-17(6-4-16)24-21(26)15-8-12-25(13-9-15)20-18-10-14-29-19(18)7-11-23-20/h3-7,10-11,14-15H,2,8-9,12-13H2,1H3,(H,24,26)