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

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1-allyl-6-amino-4-oxo-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[(6-amino-4-oxo-1-prop-2-enyl-2-pyrimidinyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(6-amino-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[(1-allyl-6-amino-4-keto-pyrimidin-2-yl)thio]methyl]-1H-quinazolin-4-one Formula: C16H15N5O2S MolecularWeight: 341.3876

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=CC(=O)N=C1SCC2=NC(=O)C3=CC=CC=C3N2)N

Isomeric SMILES

C=CCN1C(=CC(=O)N=C1SCC2=NC(=O)C3=CC=CC=C3N2)N

InChI

InChI=1S/C16H15N5O2S/c1-2-7-21-12(17)8-14(22)20-16(21)24-9-13-18-11-6-4-3-5-10(11)15(23)19-13/h2-6,8H,1,7,9,17H2,(H,18,19,23)