5-azanyl-3H-1,3,4-thiadiazole-2-thione; 2-[3,5-bis(chloranyl)phenyl]-1-hexyl-piperazine

Systemtic Name: 5-azanyl-3H-1,3,4-thiadiazole-2-thione; 2-[3,5-bis(chloranyl)phenyl]-1-hexyl-piperazine Openeye Name: 5-amino-3H-1,3,4-thiadiazole-2-thione; 2-(3,5-dichlorophenyl)-1-hexyl-piperazine CAS Name: 5-amino-3H-1,3,4-thiadiazole-2-thione; 2-(3,5-dichlorophenyl)-1-hexylpiperazine IUPAC Name: 5-amino-3H-1,3,4-thiadiazole-2-thione; 2-(3,5-dichlorophenyl)-1-hexylpiperazine Traditional Name: 5-amino-3H-1,3,4-thiadiazole-2-thione; 2-(3,5-dichlorophenyl)-1-hexyl-piperazine Formula: C18H27Cl2N5S2 MolecularWeight: 448.47648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCNCC1C2=CC(=CC(=C2)Cl)Cl.C1(=NNC(=S)S1)N

Isomeric SMILES

CCCCCCN1CCNCC1C2=CC(=CC(=C2)Cl)Cl.C1(=NNC(=S)S1)N

InChI

InChI=1S/C16H24Cl2N2.C2H3N3S2/c1-2-3-4-5-7-20-8-6-19-12-16(20)13-9-14(17)11-15(18)10-13;3-1-4-5-2(6)7-1/h9-11,16,19H,2-8,12H2,1H3;(H2,3,4)(H,5,6)