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

Systemtic Name: N-[(2-methylphenyl)methyl]-3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-amine Openeye Name: N-(o-tolylmethyl)-3-(1-phenyltetrazol-5-yl)sulfanyl-propan-1-amine CAS Name: N-[(2-methylphenyl)methyl]-3-[(1-phenyl-5-tetrazolyl)thio]-1-propanamine IUPAC Name: N-[(2-methylphenyl)methyl]-3-(1-phenyltetrazol-5-yl)sulfanylpropan-1-amine Traditional Name: (2-methylbenzyl)-[3-[(1-phenyltetrazol-5-yl)thio]propyl]amine Formula: C18H21N5S MolecularWeight: 339.45784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNCCCSC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CNCCCSC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C18H21N5S/c1-15-8-5-6-9-16(15)14-19-12-7-13-24-18-20-21-22-23(18)17-10-3-2-4-11-17/h2-6,8-11,19H,7,12-14H2,1H3