3-(phenylmethylsulfanyl)-4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 3-(phenylmethylsulfanyl)-4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 4-allyl-3-benzylsulfanyl-5-(2-thienyl)-1,2,4-triazole CAS Name: 3-(phenylmethylthio)-4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 4-allyl-3-(benzylthio)-5-(2-thienyl)-1,2,4-triazole Formula: C16H15N3S2 MolecularWeight: 313.4404

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C16H15N3S2/c1-2-10-19-15(14-9-6-11-20-14)17-18-16(19)21-12-13-7-4-3-5-8-13/h2-9,11H,1,10,12H2