2-[5-[(3-methoxyphenyl)methylsulfanyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]ethanamine

Systemtic Name: 2-[5-[(3-methoxyphenyl)methylsulfanyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]ethanamine Openeye Name: 2-[4-benzyl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethanamine CAS Name: 2-[5-[(3-methoxyphenyl)methylthio]-4-(phenylmethyl)-1,2,4-triazol-3-yl]ethanamine IUPAC Name: 2-[4-benzyl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethanamine Traditional Name: 2-[4-benzyl-5-(m-anisylthio)-1,2,4-triazol-3-yl]ethylamine Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NN=C(N2CC3=CC=CC=C3)CCN

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NN=C(N2CC3=CC=CC=C3)CCN

InChI

InChI=1S/C19H22N4OS/c1-24-17-9-5-8-16(12-17)14-25-19-22-21-18(10-11-20)23(19)13-15-6-3-2-4-7-15/h2-9,12H,10-11,13-14,20H2,1H3