N-[(4-methylphenyl)methyl]-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamine

Systemtic Name: N-[(4-methylphenyl)methyl]-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamine Openeye Name: 2-(1-methyltetrazol-5-yl)sulfanyl-N-(p-tolylmethyl)ethanamine CAS Name: N-[(4-methylphenyl)methyl]-2-[(1-methyl-5-tetrazolyl)thio]ethanamine IUPAC Name: N-[(4-methylphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine Traditional Name: (4-methylbenzyl)-[2-[(1-methyltetrazol-5-yl)thio]ethyl]amine Formula: C12H17N5S MolecularWeight: 263.36188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNCCSC2=NN=NN2C

Isomeric SMILES

CC1=CC=C(C=C1)CNCCSC2=NN=NN2C

InChI

InChI=1S/C12H17N5S/c1-10-3-5-11(6-4-10)9-13-7-8-18-12-14-15-16-17(12)2/h3-6,13H,7-9H2,1-2H3