ethyl (4S)-2-(3-ethoxy-3-oxidanylidene-propyl)sulfanyl-6-methyl-4-thiophen-2-yl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-2-(3-ethoxy-3-oxidanylidene-propyl)sulfanyl-6-methyl-4-thiophen-2-yl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (4S)-2-(3-ethoxy-3-oxo-propyl)sulfanyl-6-methyl-4-(2-thienyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: (4S)-2-[(3-ethoxy-3-oxopropyl)thio]-6-methyl-4-thiophen-2-yl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-2-(3-ethoxy-3-oxopropyl)sulfanyl-6-methyl-4-thiophen-2-yl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: (4S)-2-[(3-ethoxy-3-keto-propyl)thio]-6-methyl-4-(2-thienyl)-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C17H22N2O4S2 MolecularWeight: 382.49758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1=NC(C(=C(N1)C)C(=O)OCC)C2=CC=CS2

Isomeric SMILES

CCOC(=O)CCSC1=N[C@@H](C(=C(N1)C)C(=O)OCC)C2=CC=CS2

InChI

InChI=1S/C17H22N2O4S2/c1-4-22-13(20)8-10-25-17-18-11(3)14(16(21)23-5-2)15(19-17)12-7-6-9-24-12/h6-7,9,15H,4-5,8,10H2,1-3H3,(H,18,19)/t15-/m1/s1