2-[4-[(4-cyclopropyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[(4-cyclopropyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-[[4-cyclopropyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[(4-cyclopropyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-1-piperazinyl]-N-propylacetamide IUPAC Name: 2-[4-[(4-cyclopropyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-N-propylacetamide Traditional Name: 2-[4-[[4-cyclopropyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazino]-N-propyl-acetamide Formula: C20H29N7OS MolecularWeight: 415.55556

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4CC4

Isomeric SMILES

CCCNC(=O)CN1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4CC4

InChI

InChI=1S/C20H29N7OS/c1-2-7-22-18(28)14-24-10-12-25(13-11-24)15-26-20(29)27(17-3-4-17)19(23-26)16-5-8-21-9-6-16/h5-6,8-9,17H,2-4,7,10-15H2,1H3,(H,22,28)