2-[(1R)-1-(6-azanyl-4-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanylethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(1R)-1-(6-azanyl-4-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanylethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1R)-1-(6-amino-4-oxo-1-phenyl-pyrimidin-2-yl)sulfanylethyl]-1H-quinazolin-4-one CAS Name: 2-[(1R)-1-[(6-amino-4-oxo-1-phenyl-2-pyrimidinyl)thio]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[(1R)-1-(6-amino-4-oxo-1-phenylpyrimidin-2-yl)sulfanylethyl]-1H-quinazolin-4-one Traditional Name: 2-[(1R)-1-[(6-amino-4-keto-1-phenyl-pyrimidin-2-yl)thio]ethyl]-1H-quinazolin-4-one Formula: C20H17N5O2S MolecularWeight: 391.44628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)SC3=NC(=O)C=C(N3C4=CC=CC=C4)N

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)SC3=NC(=O)C=C(N3C4=CC=CC=C4)N

InChI

InChI=1S/C20H17N5O2S/c1-12(18-22-15-10-6-5-9-14(15)19(27)24-18)28-20-23-17(26)11-16(21)25(20)13-7-3-2-4-8-13/h2-12H,21H2,1H3,(H,22,24,27)/t12-/m1/s1