4-methyl-3-(3-phenylpropylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-methyl-3-(3-phenylpropylsulfanyl)-1,2,4-triazole Openeye Name: 4-methyl-3-(3-phenylpropylsulfanyl)-1,2,4-triazole CAS Name: 4-methyl-3-(3-phenylpropylthio)-1,2,4-triazole IUPAC Name: 4-methyl-3-(3-phenylpropylsulfanyl)-1,2,4-triazole Traditional Name: 4-methyl-3-(3-phenylpropylthio)-1,2,4-triazole Formula: C12H15N3S MolecularWeight: 233.3326

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCCCC2=CC=CC=C2

Isomeric SMILES

CN1C=NN=C1SCCCC2=CC=CC=C2

InChI

InChI=1S/C12H15N3S/c1-15-10-13-14-12(15)16-9-5-8-11-6-3-2-4-7-11/h2-4,6-7,10H,5,8-9H2,1H3