1-(azocan-1-ylmethyl)-4-(4-methoxyphenyl)-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-(azocan-1-ylmethyl)-4-(4-methoxyphenyl)-1,2,3,4-tetrazole-5-thione Openeye Name: 1-(azocan-1-ylmethyl)-4-(4-methoxyphenyl)tetrazole-5-thione CAS Name: 1-(1-azocanylmethyl)-4-(4-methoxyphenyl)-5-tetrazolethione IUPAC Name: 1-(azocan-1-ylmethyl)-4-(4-methoxyphenyl)tetrazole-5-thione Traditional Name: 1-(azocan-1-ylmethyl)-4-(4-methoxyphenyl)tetrazole-5-thione Formula: C16H23N5OS MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=S)N(N=N2)CN3CCCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=S)N(N=N2)CN3CCCCCCC3

InChI

InChI=1S/C16H23N5OS/c1-22-15-9-7-14(8-10-15)21-16(23)20(17-18-21)13-19-11-5-3-2-4-6-12-19/h7-10H,2-6,11-13H2,1H3