2-(azocan-1-ylmethyl)-5-(2-bromophenyl)-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-(azocan-1-ylmethyl)-5-(2-bromophenyl)-1H-1,2,4-triazole-3-thione Openeye Name: 2-(azocan-1-ylmethyl)-5-(2-bromophenyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-(1-azocanylmethyl)-5-(2-bromophenyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 2-(azocan-1-ylmethyl)-5-(2-bromophenyl)-1H-1,2,4-triazole-3-thione Traditional Name: 2-(azocan-1-ylmethyl)-5-(2-bromophenyl)-1H-1,2,4-triazole-3-thione Formula: C16H21BrN4S MolecularWeight: 381.33374

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)CN2C(=S)N=C(N2)C3=CC=CC=C3Br

Isomeric SMILES

C1CCCN(CCC1)CN2C(=S)N=C(N2)C3=CC=CC=C3Br

InChI

InChI=1S/C16H21BrN4S/c17-14-9-5-4-8-13(14)15-18-16(22)21(19-15)12-20-10-6-2-1-3-7-11-20/h4-5,8-9H,1-3,6-7,10-12H2,(H,18,19,22)