2-[[4-(4-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile

Systemtic Name: 2-[[4-(4-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile Openeye Name: 2-[[5-morpholino-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile CAS Name: 2-[[4-(4-methylphenyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]-3-pyridinecarbonitrile IUPAC Name: 2-[[4-(4-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile Traditional Name: 2-[[5-morpholino-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]nicotinonitrile Formula: C19H18N6OS MolecularWeight: 378.45082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SC3=C(C=CC=N3)C#N)N4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SC3=C(C=CC=N3)C#N)N4CCOCC4

InChI

InChI=1S/C19H18N6OS/c1-14-4-6-16(7-5-14)25-18(24-9-11-26-12-10-24)22-23-19(25)27-17-15(13-20)3-2-8-21-17/h2-8H,9-12H2,1H3