4,6-bis[(3-methoxyphenyl)sulfanyl]-2-methylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4,6-bis[(3-methoxyphenyl)sulfanyl]-2-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4,6-bis[(3-methoxyphenyl)sulfanyl]-2-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 4,6-bis[(3-methoxyphenyl)thio]-2-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4,6-bis[(3-methoxyphenyl)sulfanyl]-2-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4,6-bis[(3-methoxyphenyl)thio]-2-(methylthio)pyrimidine-5-carbonitrile Formula: C20H17N3O2S3 MolecularWeight: 427.56288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SC2=C(C(=NC(=N2)SC)SC3=CC=CC(=C3)OC)C#N

Isomeric SMILES

COC1=CC(=CC=C1)SC2=C(C(=NC(=N2)SC)SC3=CC=CC(=C3)OC)C#N

InChI

InChI=1S/C20H17N3O2S3/c1-24-13-6-4-8-15(10-13)27-18-17(12-21)19(23-20(22-18)26-3)28-16-9-5-7-14(11-16)25-2/h4-11H,1-3H3