3-phenyl-1-[4-[4-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]piperidin-1-yl]prop-2-yn-1-one

Systemtic Name: 3-phenyl-1-[4-[4-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]piperidin-1-yl]prop-2-yn-1-one Openeye Name: 3-phenyl-1-[4-[4-[4-[2-(2-thienyl)ethyl]piperazine-1-carbonyl]thiazol-2-yl]-1-piperidyl]prop-2-yn-1-one CAS Name: 1-[4-[4-[oxo-[4-(2-thiophen-2-ylethyl)-1-piperazinyl]methyl]-2-thiazolyl]-1-piperidinyl]-3-phenyl-2-propyn-1-one IUPAC Name: 3-phenyl-1-[4-[4-[4-(2-thiophen-2-ylethyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl]piperidin-1-yl]prop-2-yn-1-one Traditional Name: 3-phenyl-1-[4-[4-[4-[2-(2-thienyl)ethyl]piperazine-1-carbonyl]thiazol-2-yl]piperidino]prop-2-yn-1-one Formula: C28H30N4O2S2 MolecularWeight: 518.6934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C(=O)N3CCN(CC3)CCC4=CC=CS4)C(=O)C#CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C(=O)N3CCN(CC3)CCC4=CC=CS4)C(=O)C#CC5=CC=CC=C5

InChI

InChI=1S/C28H30N4O2S2/c33-26(9-8-22-5-2-1-3-6-22)31-14-10-23(11-15-31)27-29-25(21-36-27)28(34)32-18-16-30(17-19-32)13-12-24-7-4-20-35-24/h1-7,20-21,23H,10-19H2