methyl 5-ethyl-2-[(1-ethylpiperidin-4-yl)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-ethyl-2-[(1-ethylpiperidin-4-yl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-[(1-ethyl-4-piperidyl)carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[[(1-ethyl-4-piperidinyl)amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-[(1-ethylpiperidin-4-yl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[(1-ethyl-4-piperidyl)thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C16H25N3O2S2 MolecularWeight: 355.5186

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NC2CCN(CC2)CC)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NC2CCN(CC2)CC)C(=O)OC

InChI

InChI=1S/C16H25N3O2S2/c1-4-12-10-13(15(20)21-3)14(23-12)18-16(22)17-11-6-8-19(5-2)9-7-11/h10-11H,4-9H2,1-3H3,(H2,17,18,22)