2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(pyridin-3-ylmethyl)ethanamine

Systemtic Name: 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(pyridin-3-ylmethyl)ethanamine Openeye Name: 2-(1-phenyltetrazol-5-yl)sulfanyl-N-(3-pyridylmethyl)ethanamine CAS Name: 2-[(1-phenyl-5-tetrazolyl)thio]-N-(3-pyridinylmethyl)ethanamine IUPAC Name: 2-(1-phenyltetrazol-5-yl)sulfanyl-N-(pyridin-3-ylmethyl)ethanamine Traditional Name: 2-[(1-phenyltetrazol-5-yl)thio]ethyl-(3-pyridylmethyl)amine Formula: C15H16N6S MolecularWeight: 312.39274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCCNCC3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCCNCC3=CN=CC=C3

InChI

InChI=1S/C15H16N6S/c1-2-6-14(7-3-1)21-15(18-19-20-21)22-10-9-17-12-13-5-4-8-16-11-13/h1-8,11,17H,9-10,12H2