4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]-N-[2-(cyclohexen-1-yl)ethyl]piperidine-1-carbothioamide

Systemtic Name: 4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]-N-[2-(cyclohexen-1-yl)ethyl]piperidine-1-carbothioamide Openeye Name: 4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]-N-[2-(cyclohexen-1-yl)ethyl]piperidine-1-carbothioamide CAS Name: 4-[1-(1-benzotriazolylmethyl)-2-imidazolyl]-N-[2-(1-cyclohexenyl)ethyl]-1-piperidinecarbothioamide IUPAC Name: 4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]-N-[2-(cyclohexen-1-yl)ethyl]piperidine-1-carbothioamide Traditional Name: 4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]-N-[2-(cyclohexen-1-yl)ethyl]piperidine-1-carbothioamide Formula: C24H31N7S MolecularWeight: 449.61484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=S)N2CCC(CC2)C3=NC=CN3CN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1CCC(=CC1)CCNC(=S)N2CCC(CC2)C3=NC=CN3CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C24H31N7S/c32-24(26-13-10-19-6-2-1-3-7-19)29-15-11-20(12-16-29)23-25-14-17-30(23)18-31-22-9-5-4-8-21(22)27-28-31/h4-6,8-9,14,17,20H,1-3,7,10-13,15-16,18H2,(H,26,32)