5-(2-chlorophenyl)-3-(3-ethoxypropyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(2-chlorophenyl)-3-(3-ethoxypropyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(2-chlorophenyl)-3-(3-ethoxypropyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(2-chlorophenyl)-3-(3-ethoxypropyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(2-chlorophenyl)-3-(3-ethoxypropyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(2-chlorophenyl)-3-(3-ethoxypropyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C17H17ClN2O2S2 MolecularWeight: 380.91208

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=C(NC1=S)SC=C2C3=CC=CC=C3Cl

Isomeric SMILES

CCOCCCN1C(=O)C2=C(NC1=S)SC=C2C3=CC=CC=C3Cl

InChI

InChI=1S/C17H17ClN2O2S2/c1-2-22-9-5-8-20-16(21)14-12(10-24-15(14)19-17(20)23)11-6-3-4-7-13(11)18/h3-4,6-7,10H,2,5,8-9H2,1H3,(H,19,23)