8-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline

Systemtic Name: 8-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Openeye Name: 8-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline CAS Name: 8-[[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]quinoline IUPAC Name: 8-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Traditional Name: 8-[[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]quinoline Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC1=NN=C(N1CC=C)SCC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C16H16N4S/c1-3-10-20-12(2)18-19-16(20)21-11-14-7-4-6-13-8-5-9-17-15(13)14/h3-9H,1,10-11H2,2H3