4-anthracen-9-yl-1-methyl-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carbonitrile

Systemtic Name: 4-anthracen-9-yl-1-methyl-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carbonitrile Openeye Name: 4-(9-anthryl)-1-methyl-2-methylsulfanyl-6-oxo-pyrimidine-5-carbonitrile CAS Name: 4-(9-anthracenyl)-1-methyl-2-(methylthio)-6-oxo-5-pyrimidinecarbonitrile IUPAC Name: 4-anthracen-9-yl-1-methyl-2-methylsulfanyl-6-oxopyrimidine-5-carbonitrile Traditional Name: 4-(9-anthryl)-6-keto-1-methyl-2-(methylthio)pyrimidine-5-carbonitrile Formula: C21H15N3OS MolecularWeight: 357.4283

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1SC)C2=C3C=CC=CC3=CC4=CC=CC=C42)C#N

Isomeric SMILES

CN1C(=O)C(=C(N=C1SC)C2=C3C=CC=CC3=CC4=CC=CC=C42)C#N

InChI

InChI=1S/C21H15N3OS/c1-24-20(25)17(12-22)19(23-21(24)26-2)18-15-9-5-3-7-13(15)11-14-8-4-6-10-16(14)18/h3-11H,1-2H3