methyl 4-[2-(4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[4-(2-thienyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-(4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-[4-(2-thienyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]amino]benzoic acid methyl ester Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CN2CCC3=C(C2C4=CC=CS4)C=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CN2CCC3=C(C2C4=CC=CS4)C=CS3

InChI

InChI=1S/C21H20N2O3S2/c1-26-21(25)14-4-6-15(7-5-14)22-19(24)13-23-10-8-17-16(9-12-28-17)20(23)18-3-2-11-27-18/h2-7,9,11-12,20H,8,10,13H2,1H3,(H,22,24)