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

Systemtic Name: methyl 2-[[(4R)-4-propyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]carbothioylamino]benzoate Openeye Name: methyl 2-[[(4R)-4-propyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbothioyl]amino]benzoate CAS Name: 2-[[[(4R)-4-propyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(4R)-4-propyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbothioyl]amino]benzoate Traditional Name: 2-[[(4R)-4-propyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbothioyl]amino]benzoic acid methyl ester Formula: C19H22N2O2S2 MolecularWeight: 374.52018

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C2=C(CCN1C(=S)NC3=CC=CC=C3C(=O)OC)SC=C2

Isomeric SMILES

CCC[C@@H]1C2=C(CCN1C(=S)NC3=CC=CC=C3C(=O)OC)SC=C2

InChI

InChI=1S/C19H22N2O2S2/c1-3-6-16-14-10-12-25-17(14)9-11-21(16)19(24)20-15-8-5-4-7-13(15)18(22)23-2/h4-5,7-8,10,12,16H,3,6,9,11H2,1-2H3,(H,20,24)/t16-/m1/s1