3-[(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanylmethyl]quinazolin-4-one

Systemtic Name: 3-[(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanylmethyl]quinazolin-4-one Openeye Name: 3-[(1-allyl-6-amino-4-oxo-pyrimidin-2-yl)sulfanylmethyl]quinazolin-4-one CAS Name: 3-[[(6-amino-4-oxo-1-prop-2-enyl-2-pyrimidinyl)thio]methyl]-4-quinazolinone IUPAC Name: 3-[(6-amino-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanylmethyl]quinazolin-4-one Traditional Name: 3-[[(1-allyl-6-amino-4-keto-pyrimidin-2-yl)thio]methyl]quinazolin-4-one Formula: C16H15N5O2S MolecularWeight: 341.3876

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=CC(=O)N=C1SCN2C=NC3=CC=CC=C3C2=O)N

Isomeric SMILES

C=CCN1C(=CC(=O)N=C1SCN2C=NC3=CC=CC=C3C2=O)N

InChI

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