1-[(4-methylphenyl)methyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[(4-methylphenyl)methyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one Openeye Name: 1-(p-tolylmethyl)-4-(2-thienyl)tetrazol-5-one CAS Name: 1-[(4-methylphenyl)methyl]-4-thiophen-2-yl-5-tetrazolone IUPAC Name: 1-[(4-methylphenyl)methyl]-4-thiophen-2-yltetrazol-5-one Traditional Name: 1-(4-methylbenzyl)-4-(2-thienyl)tetrazol-5-one Formula: C13H12N4OS MolecularWeight: 272.32558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)N(N=N2)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)N(N=N2)C3=CC=CS3

InChI

InChI=1S/C13H12N4OS/c1-10-4-6-11(7-5-10)9-16-13(18)17(15-14-16)12-3-2-8-19-12/h2-8H,9H2,1H3