3-(4-methylphenyl)-2-(3-methylquinoxalin-2-yl)sulfanyl-propanenitrile

Systemtic Name: 3-(4-methylphenyl)-2-(3-methylquinoxalin-2-yl)sulfanyl-propanenitrile Openeye Name: 2-(3-methylquinoxalin-2-yl)sulfanyl-3-(p-tolyl)propanenitrile CAS Name: 3-(4-methylphenyl)-2-[(3-methyl-2-quinoxalinyl)thio]propanenitrile IUPAC Name: 3-(4-methylphenyl)-2-(3-methylquinoxalin-2-yl)sulfanylpropanenitrile Traditional Name: 2-[(3-methylquinoxalin-2-yl)thio]-3-(p-tolyl)propionitrile Formula: C19H17N3S MolecularWeight: 319.42338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C#N)SC2=NC3=CC=CC=C3N=C2C

Isomeric SMILES

CC1=CC=C(C=C1)CC(C#N)SC2=NC3=CC=CC=C3N=C2C

InChI

InChI=1S/C19H17N3S/c1-13-7-9-15(10-8-13)11-16(12-20)23-19-14(2)21-17-5-3-4-6-18(17)22-19/h3-10,16H,11H2,1-2H3