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

Systemtic Name: 3-(methoxymethyl)-5-(phenylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-benzylsulfanyl-5-(methoxymethyl)-1,2,4-triazole CAS Name: 3-(methoxymethyl)-5-(phenylmethylthio)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-(methoxymethyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-(benzylthio)-5-(methoxymethyl)-1,2,4-triazole Formula: C14H17N3OS MolecularWeight: 275.36928

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NN=C(N1CC=C)SCC2=CC=CC=C2

Isomeric SMILES

COCC1=NN=C(N1CC=C)SCC2=CC=CC=C2

InChI

InChI=1S/C14H17N3OS/c1-3-9-17-13(10-18-2)15-16-14(17)19-11-12-7-5-4-6-8-12/h3-8H,1,9-11H2,2H3