3,5,6-trimethyl-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3,5,6-trimethyl-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3,5,6-trimethyl-2-(4-oxo-4-phenyl-butyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3,5,6-trimethyl-2-[(4-oxo-4-phenylbutyl)thio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3,5,6-trimethyl-2-(4-oxo-4-phenylbutyl)sulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-keto-4-phenyl-butyl)thio]-3,5,6-trimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C19H20N2O2S2 MolecularWeight: 372.5043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCCCC(=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCCCC(=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C19H20N2O2S2/c1-12-13(2)25-17-16(12)18(23)21(3)19(20-17)24-11-7-10-15(22)14-8-5-4-6-9-14/h4-6,8-9H,7,10-11H2,1-3H3