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

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[(6-amino-4-oxo-1-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[(6-amino-4-oxo-1-phenyl-2-pyrimidinyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(6-amino-4-oxo-1-phenylpyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[(6-amino-4-keto-1-phenyl-pyrimidin-2-yl)thio]methyl]-1H-quinazolin-4-one Formula: C19H15N5O2S MolecularWeight: 377.4197

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CC(=O)N=C2SCC3=NC(=O)C4=CC=CC=C4N3)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CC(=O)N=C2SCC3=NC(=O)C4=CC=CC=C4N3)N

InChI

InChI=1S/C19H15N5O2S/c20-15-10-17(25)23-19(24(15)12-6-2-1-3-7-12)27-11-16-21-14-9-5-4-8-13(14)18(26)22-16/h1-10H,11,20H2,(H,21,22,26)