4-(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanylcarbothioylsulfanyl-6-methyl-2-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanylcarbothioylsulfanyl-6-methyl-2-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanylcarbothioylsulfanyl-6-methyl-2-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-[[[(5-cyano-6-methyl-2-phenyl-4-pyrimidinyl)thio]-sulfanylidenemethyl]thio]-6-methyl-2-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-(5-cyano-6-methyl-2-phenylpyrimidin-4-yl)sulfanylcarbothioylsulfanyl-6-methyl-2-phenylpyrimidine-5-carbonitrile Traditional Name: 4-[[(5-cyano-6-methyl-2-phenyl-pyrimidin-4-yl)thio]carbothioylthio]-6-methyl-2-phenyl-pyrimidine-5-carbonitrile Formula: C25H16N6S3 MolecularWeight: 496.62974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SC(=S)SC3=NC(=NC(=C3C#N)C)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SC(=S)SC3=NC(=NC(=C3C#N)C)C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H16N6S3/c1-15-19(13-26)23(30-21(28-15)17-9-5-3-6-10-17)33-25(32)34-24-20(14-27)16(2)29-22(31-24)18-11-7-4-8-12-18/h3-12H,1-2H3