N-[(E)-1-pyridin-2-ylethylideneamino]-4-[1-[[(E)-1-pyridin-2-ylethylideneamino]carbamothioyl]piperidin-4-yl]piperidine-1-carbothioamide

Systemtic Name: N-[(E)-1-pyridin-2-ylethylideneamino]-4-[1-[[(E)-1-pyridin-2-ylethylideneamino]carbamothioyl]piperidin-4-yl]piperidine-1-carbothioamide Openeye Name: N-[(E)-1-(2-pyridyl)ethylideneamino]-4-[1-[[(E)-1-(2-pyridyl)ethylideneamino]carbamothioyl]-4-piperidyl]piperidine-1-carbothioamide CAS Name: N-[(E)-1-(2-pyridinyl)ethylideneamino]-4-[1-[[(2E)-2-[1-(2-pyridinyl)ethylidene]hydrazinyl]-sulfanylidenemethyl]-4-piperidinyl]-1-piperidinecarbothioamide IUPAC Name: N-[(E)-1-pyridin-2-ylethylideneamino]-4-[1-[[(E)-1-pyridin-2-ylethylideneamino]carbamothioyl]piperidin-4-yl]piperidine-1-carbothioamide Traditional Name: N-[(E)-1-(2-pyridyl)ethylideneamino]-4-[1-[[(E)-1-(2-pyridyl)ethylideneamino]thiocarbamoyl]-4-piperidyl]piperidine-1-carbothioamide Formula: C26H34N8S2 MolecularWeight: 522.73176

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N1CCC(CC1)C2CCN(CC2)C(=S)NN=C(C)C3=CC=CC=N3)C4=CC=CC=N4

Isomeric SMILES

C/C(=N\NC(=S)N1CCC(CC1)C2CCN(CC2)C(=S)N/N=C(/C3=CC=CC=N3)\C)/C4=CC=CC=N4

InChI

InChI=1S/C26H34N8S2/c1-19(23-7-3-5-13-27-23)29-31-25(35)33-15-9-21(10-16-33)22-11-17-34(18-12-22)26(36)32-30-20(2)24-8-4-6-14-28-24/h3-8,13-14,21-22H,9-12,15-18H2,1-2H3,(H,31,35)(H,32,36)/b29-19+,30-20+