3-(phenylmethyl)-4-propyl-5-prop-2-ynylsulfanyl-1,2,4-triazole

Systemtic Name: 3-(phenylmethyl)-4-propyl-5-prop-2-ynylsulfanyl-1,2,4-triazole Openeye Name: 3-benzyl-4-propyl-5-prop-2-ynylsulfanyl-1,2,4-triazole CAS Name: 3-(phenylmethyl)-4-propyl-5-(prop-2-ynylthio)-1,2,4-triazole IUPAC Name: 3-benzyl-4-propyl-5-prop-2-ynylsulfanyl-1,2,4-triazole Traditional Name: 3-benzyl-5-(propargylthio)-4-propyl-1,2,4-triazole Formula: C15H17N3S MolecularWeight: 271.38058

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC#C)CC2=CC=CC=C2

Isomeric SMILES

CCCN1C(=NN=C1SCC#C)CC2=CC=CC=C2

InChI

InChI=1S/C15H17N3S/c1-3-10-18-14(12-13-8-6-5-7-9-13)16-17-15(18)19-11-4-2/h2,5-9H,3,10-12H2,1H3