2-methyl-4-methylsulfanyl-6-[3-(phenylsulfanylmethyl)phenyl]pyrimidine-5-carbonitrile

Systemtic Name: 2-methyl-4-methylsulfanyl-6-[3-(phenylsulfanylmethyl)phenyl]pyrimidine-5-carbonitrile Openeye Name: 2-methyl-4-methylsulfanyl-6-[3-(phenylsulfanylmethyl)phenyl]pyrimidine-5-carbonitrile CAS Name: 2-methyl-4-(methylthio)-6-[3-[(phenylthio)methyl]phenyl]-5-pyrimidinecarbonitrile IUPAC Name: 2-methyl-4-methylsulfanyl-6-[3-(phenylsulfanylmethyl)phenyl]pyrimidine-5-carbonitrile Traditional Name: 2-methyl-4-(methylthio)-6-[3-[(phenylthio)methyl]phenyl]pyrimidine-5-carbonitrile Formula: C20H17N3S2 MolecularWeight: 363.49908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)SC)C#N)C2=CC(=CC=C2)CSC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=C(C(=N1)SC)C#N)C2=CC(=CC=C2)CSC3=CC=CC=C3

InChI

InChI=1S/C20H17N3S2/c1-14-22-19(18(12-21)20(23-14)24-2)16-8-6-7-15(11-16)13-25-17-9-4-3-5-10-17/h3-11H,13H2,1-2H3