2-azanyl-4-(4-methoxyphenyl)-6-methylsulfanyl-5-phenyl-benzene-1,3-dicarbonitrile

Systemtic Name: 2-azanyl-4-(4-methoxyphenyl)-6-methylsulfanyl-5-phenyl-benzene-1,3-dicarbonitrile Openeye Name: 2-amino-4-(4-methoxyphenyl)-6-methylsulfanyl-5-phenyl-benzene-1,3-dicarbonitrile CAS Name: 2-amino-4-(4-methoxyphenyl)-6-(methylthio)-5-phenylbenzene-1,3-dicarbonitrile IUPAC Name: 2-amino-4-(4-methoxyphenyl)-6-methylsulfanyl-5-phenylbenzene-1,3-dicarbonitrile Traditional Name: 2-amino-4-(4-methoxyphenyl)-6-(methylthio)-5-phenyl-isophthalonitrile Formula: C22H17N3OS MolecularWeight: 371.45488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=C(C(=C2C3=CC=CC=C3)SC)C#N)N)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=C(C(=C2C3=CC=CC=C3)SC)C#N)N)C#N

InChI

InChI=1S/C22H17N3OS/c1-26-16-10-8-15(9-11-16)19-17(12-23)21(25)18(13-24)22(27-2)20(19)14-6-4-3-5-7-14/h3-11H,25H2,1-2H3