3-(3-methylphenyl)-4-prop-2-enyl-5-(thiophen-2-ylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(3-methylphenyl)-4-prop-2-enyl-5-(thiophen-2-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 4-allyl-3-(m-tolyl)-5-(2-thienylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(3-methylphenyl)-4-prop-2-enyl-5-(thiophen-2-ylmethylthio)-1,2,4-triazole IUPAC Name: 3-(3-methylphenyl)-4-prop-2-enyl-5-(thiophen-2-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 4-allyl-3-(m-tolyl)-5-(2-thenylthio)-1,2,4-triazole Formula: C17H17N3S2 MolecularWeight: 327.46698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC3=CC=CS3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC3=CC=CS3

InChI

InChI=1S/C17H17N3S2/c1-3-9-20-16(14-7-4-6-13(2)11-14)18-19-17(20)22-12-15-8-5-10-21-15/h3-8,10-11H,1,9,12H2,2H3