3-methyl-2-(2-methylpropylsulfanyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-methyl-2-(2-methylpropylsulfanyl)-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-isobutylsulfanyl-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-methyl-2-(2-methylpropylthio)-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-methyl-2-(2-methylpropylsulfanyl)-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(isobutylthio)-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C17H18N2OS2 MolecularWeight: 330.46762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1C

Isomeric SMILES

CC(C)CSC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1C

InChI

InChI=1S/C17H18N2OS2/c1-11(2)9-22-17-18-15-14(16(20)19(17)3)13(10-21-15)12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3