2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-5-prop-2-enyl-1H-pyrimidin-4-olate

Systemtic Name: 2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-5-prop-2-enyl-1H-pyrimidin-4-olate Openeye Name: 5-allyl-2-[2-(3-methoxyanilino)-2-oxo-ethyl]sulfanyl-6-oxo-1H-pyrimidin-4-olate CAS Name: 2-[[2-(3-methoxyanilino)-2-oxoethyl]thio]-6-oxo-5-prop-2-enyl-1H-pyrimidin-4-olate IUPAC Name: 2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-6-oxo-5-prop-2-enyl-1H-pyrimidin-4-olate Traditional Name: 5-allyl-6-keto-2-[[2-keto-2-(m-anisidino)ethyl]thio]-1H-pyrimidin-4-olate Formula: C16H16N3O4S- MolecularWeight: 346.38094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CSC2=NC(=C(C(=O)N2)CC=C)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CSC2=NC(=C(C(=O)N2)CC=C)[O-]

InChI

InChI=1S/C16H17N3O4S/c1-3-5-12-14(21)18-16(19-15(12)22)24-9-13(20)17-10-6-4-7-11(8-10)23-2/h3-4,6-8H,1,5,9H2,2H3,(H,17,20)(H2,18,19,21,22)/p-1