4-azanyl-2-[2-(4-methylpyridin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-1H-pyrimidin-3-ium-6-one

Systemtic Name: 4-azanyl-2-[2-(4-methylpyridin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-1H-pyrimidin-3-ium-6-one Openeye Name: 3-allyl-4-amino-2-[2-(4-methyl-2-pyridyl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-3-ium-6-one CAS Name: 4-amino-2-[[2-(4-methyl-2-pyridinyl)-2-oxoethyl]thio]-3-prop-2-enyl-1H-pyrimidin-3-ium-6-one IUPAC Name: 4-amino-2-[2-(4-methylpyridin-2-yl)-2-oxoethyl]sulfanyl-3-prop-2-enyl-1H-pyrimidin-3-ium-6-one Traditional Name: 3-allyl-4-amino-2-[[2-keto-2-(4-methyl-2-pyridyl)ethyl]thio]-1H-pyrimidin-3-ium-6-one Formula: C15H17N4O2S+ MolecularWeight: 317.38608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C(=O)CSC2=[N+](C(=CC(=O)N2)N)CC=C

Isomeric SMILES

CC1=CC(=NC=C1)C(=O)CSC2=[N+](C(=CC(=O)N2)N)CC=C

InChI

InChI=1S/C15H16N4O2S/c1-3-6-19-13(16)8-14(21)18-15(19)22-9-12(20)11-7-10(2)4-5-17-11/h3-5,7-8H,1,6,9H2,2H3,(H2,16,21)/p+1