2-(azocan-1-ylmethyl)-4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 2-(azocan-1-ylmethyl)-4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 2-(azocan-1-ylmethyl)-4-methyl-5-(2-thienylmethyl)-1,2,4-triazole-3-thione CAS Name: 2-(1-azocanylmethyl)-4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 2-(azocan-1-ylmethyl)-4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 2-(azocan-1-ylmethyl)-4-methyl-5-(2-thenyl)-1,2,4-triazole-3-thione Formula: C16H24N4S2 MolecularWeight: 336.51856

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCCCCCC2)CC3=CC=CS3

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCCCCCC2)CC3=CC=CS3

InChI

InChI=1S/C16H24N4S2/c1-18-15(12-14-8-7-11-22-14)17-20(16(18)21)13-19-9-5-3-2-4-6-10-19/h7-8,11H,2-6,9-10,12-13H2,1H3