N-tert-butyl-2-[4-[2-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-[2-[3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]piperazin-1-yl]-N-tert-butyl-acetamide CAS Name: N-tert-butyl-2-[4-[2-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-oxoethyl]-1-piperazinyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-oxoethyl]piperazin-1-yl]acetamide Traditional Name: 2-[4-[2-[3,5-bis(2-thienyl)-2-pyrazolin-1-yl]-2-keto-ethyl]piperazino]-N-tert-butyl-acetamide Formula: C23H31N5O2S2 MolecularWeight: 473.65454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCN(CC1)CC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCN(CC1)CC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C23H31N5O2S2/c1-23(2,3)24-21(29)15-26-8-10-27(11-9-26)16-22(30)28-18(20-7-5-13-32-20)14-17(25-28)19-6-4-12-31-19/h4-7,12-13,18H,8-11,14-16H2,1-3H3,(H,24,29)