2-(4-methylphenyl)-4-(5-propan-2-ylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)quinoline

Systemtic Name: 2-(4-methylphenyl)-4-(5-propan-2-ylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)quinoline Openeye Name: 4-(4-allyl-5-isopropylsulfanyl-1,2,4-triazol-3-yl)-2-(p-tolyl)quinoline CAS Name: 2-(4-methylphenyl)-4-[5-(propan-2-ylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]quinoline IUPAC Name: 2-(4-methylphenyl)-4-(5-propan-2-ylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)quinoline Traditional Name: 4-[4-allyl-5-(isopropylthio)-1,2,4-triazol-3-yl]-2-(p-tolyl)quinoline Formula: C24H24N4S MolecularWeight: 400.53916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C4=NN=C(N4CC=C)SC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C4=NN=C(N4CC=C)SC(C)C

InChI

InChI=1S/C24H24N4S/c1-5-14-28-23(26-27-24(28)29-16(2)3)20-15-22(18-12-10-17(4)11-13-18)25-21-9-7-6-8-19(20)21/h5-13,15-16H,1,14H2,2-4H3