ethyl 2-(cyclopentylcarbonylcarbamothioylamino)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: ethyl 2-(cyclopentylcarbonylcarbamothioylamino)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: ethyl 6-benzyl-2-(cyclopentanecarbonylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-[[[[cyclopentyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-benzyl-2-(cyclopentanecarbonylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 6-benzyl-2-(cyclopentanecarbonylthiocarbamoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester Formula: C24H29N3O3S2 MolecularWeight: 471.63536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)NC(=S)NC(=O)C4CCCC4

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)NC(=S)NC(=O)C4CCCC4

InChI

InChI=1S/C24H29N3O3S2/c1-2-30-23(29)20-18-12-13-27(14-16-8-4-3-5-9-16)15-19(18)32-22(20)26-24(31)25-21(28)17-10-6-7-11-17/h3-5,8-9,17H,2,6-7,10-15H2,1H3,(H2,25,26,28,31)