N-[3-[3-oxidanylidene-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-1-ynyl]phenyl]ethanamide

Systemtic Name: N-[3-[3-oxidanylidene-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-1-ynyl]phenyl]ethanamide Openeye Name: N-[3-[3-oxo-3-(4-thiazol-2-ylpiperazin-1-yl)prop-1-ynyl]phenyl]acetamide CAS Name: N-[3-[3-oxo-3-[4-(2-thiazolyl)-1-piperazinyl]prop-1-ynyl]phenyl]acetamide IUPAC Name: N-[3-[3-oxo-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-1-ynyl]phenyl]acetamide Traditional Name: N-[3-[3-keto-3-(4-thiazol-2-ylpiperazino)prop-1-ynyl]phenyl]acetamide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C#CC(=O)N2CCN(CC2)C3=NC=CS3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C#CC(=O)N2CCN(CC2)C3=NC=CS3

InChI

InChI=1S/C18H18N4O2S/c1-14(23)20-16-4-2-3-15(13-16)5-6-17(24)21-8-10-22(11-9-21)18-19-7-12-25-18/h2-4,7,12-13H,8-11H2,1H3,(H,20,23)