ethyl 5-phenyl-2-(piperidin-1-ylcarbothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-phenyl-2-(piperidin-1-ylcarbothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-phenyl-2-(piperidine-1-carbothioylamino)thiophene-3-carboxylate CAS Name: 5-phenyl-2-[[1-piperidinyl(sulfanylidene)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-2-(piperidine-1-carbothioylamino)thiophene-3-carboxylate Traditional Name: 5-phenyl-2-(piperidine-1-carbothioylamino)thiophene-3-carboxylic acid ethyl ester Formula: C19H22N2O2S2 MolecularWeight: 374.52018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N3CCCCC3

InChI

InChI=1S/C19H22N2O2S2/c1-2-23-18(22)15-13-16(14-9-5-3-6-10-14)25-17(15)20-19(24)21-11-7-4-8-12-21/h3,5-6,9-10,13H,2,4,7-8,11-12H2,1H3,(H,20,24)