4-oxidanylidene-2-[(Z)-2-oxidanyl-4-oxidanylidene-pent-2-en-3-yl]sulfanyl-6-phenyl-1H-pyrimidine-5-carbonitrile

Systemtic Name: 4-oxidanylidene-2-[(Z)-2-oxidanyl-4-oxidanylidene-pent-2-en-3-yl]sulfanyl-6-phenyl-1H-pyrimidine-5-carbonitrile Openeye Name: 2-[(Z)-1-acetyl-2-hydroxy-prop-1-enyl]sulfanyl-4-oxo-6-phenyl-1H-pyrimidine-5-carbonitrile CAS Name: 2-[[(Z)-2-hydroxy-4-oxopent-2-en-3-yl]thio]-4-oxo-6-phenyl-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-[(Z)-2-hydroxy-4-oxopent-2-en-3-yl]sulfanyl-4-oxo-6-phenyl-1H-pyrimidine-5-carbonitrile Traditional Name: 2-[[(Z)-1-acetyl-2-hydroxy-prop-1-enyl]thio]-4-keto-6-phenyl-1H-pyrimidine-5-carbonitrile Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)C)SC1=NC(=O)C(=C(N1)C2=CC=CC=C2)C#N)O

Isomeric SMILES

C/C(=C(\C(=O)C)/SC1=NC(=O)C(=C(N1)C2=CC=CC=C2)C#N)/O

InChI

InChI=1S/C16H13N3O3S/c1-9(20)14(10(2)21)23-16-18-13(11-6-4-3-5-7-11)12(8-17)15(22)19-16/h3-7,20H,1-2H3,(H,18,19,22)/b14-9-