5,7-dimethyl-1-[(1R)-1-phenylethyl]-2-sulfanylidene-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 5,7-dimethyl-1-[(1R)-1-phenylethyl]-2-sulfanylidene-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 5,7-dimethyl-1-[(1R)-1-phenylethyl]-2-thioxo-pyrido[2,3-d]pyrimidin-4-one CAS Name: 5,7-dimethyl-1-[(1R)-1-phenylethyl]-2-sulfanylidene-4-pyrido[2,3-d]pyrimidinone IUPAC Name: 5,7-dimethyl-1-[(1R)-1-phenylethyl]-2-sulfanylidenepyrido[2,3-d]pyrimidin-4-one Traditional Name: 5,7-dimethyl-1-[(1R)-1-phenylethyl]-2-thioxo-pyrido[2,3-d]pyrimidin-4-one Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=O)NC(=S)N2C(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=O)NC(=S)N2[C@H](C)C3=CC=CC=C3)C

InChI

InChI=1S/C17H17N3OS/c1-10-9-11(2)18-15-14(10)16(21)19-17(22)20(15)12(3)13-7-5-4-6-8-13/h4-9,12H,1-3H3,(H,19,21,22)/t12-/m1/s1