ethyl 4-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)piperidine-1-carboxylate

Systemtic Name: ethyl 4-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)piperidine-1-carboxylate Openeye Name: ethyl 4-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]piperidine-1-carboxylate CAS Name: 4-[[1-oxo-2-(4-thieno[2,3-d]pyrimidinylthio)ethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(thieno[2,3-d]pyrimidin-4-ylthio)acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C16H20N4O3S2 MolecularWeight: 380.485

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CSC2=NC=NC3=C2C=CS3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CSC2=NC=NC3=C2C=CS3

InChI

InChI=1S/C16H20N4O3S2/c1-2-23-16(22)20-6-3-11(4-7-20)19-13(21)9-25-15-12-5-8-24-14(12)17-10-18-15/h5,8,10-11H,2-4,6-7,9H2,1H3,(H,19,21)