ethyl 2-[[(2S)-2-pyrimidin-2-ylsulfanylpropanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(2S)-2-pyrimidin-2-ylsulfanylpropanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: ethyl 2-[[(2S)-2-pyrimidin-2-ylsulfanylpropanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[(2S)-1-oxo-2-(2-pyrimidinylthio)propyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(2S)-2-pyrimidin-2-ylsulfanylpropanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[(2S)-2-(2-pyrimidylthio)propanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester Formula: C17H19N3O3S2 MolecularWeight: 377.48106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C(C)SC3=NC=CC=N3

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)[C@H](C)SC3=NC=CC=N3

InChI

InChI=1S/C17H19N3O3S2/c1-3-23-16(22)13-11-6-4-7-12(11)25-15(13)20-14(21)10(2)24-17-18-8-5-9-19-17/h5,8-10H,3-4,6-7H2,1-2H3,(H,20,21)/t10-/m0/s1