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

Systemtic Name: 3-phenyl-1-[4-[4-(4-prop-2-enylpiperazin-1-yl)carbonyl-1,3-thiazol-2-yl]piperidin-1-yl]prop-2-yn-1-one Openeye Name: 1-[4-[4-(4-allylpiperazine-1-carbonyl)thiazol-2-yl]-1-piperidyl]-3-phenyl-prop-2-yn-1-one CAS Name: 1-[4-[4-[oxo-(4-prop-2-enyl-1-piperazinyl)methyl]-2-thiazolyl]-1-piperidinyl]-3-phenyl-2-propyn-1-one IUPAC Name: 3-phenyl-1-[4-[4-(4-prop-2-enylpiperazine-1-carbonyl)-1,3-thiazol-2-yl]piperidin-1-yl]prop-2-yn-1-one Traditional Name: 1-[4-[4-(4-allylpiperazine-1-carbonyl)thiazol-2-yl]piperidino]-3-phenyl-prop-2-yn-1-one Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCN(CC1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

Isomeric SMILES

C=CCN1CCN(CC1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O2S/c1-2-12-27-15-17-29(18-16-27)25(31)22-19-32-24(26-22)21-10-13-28(14-11-21)23(30)9-8-20-6-4-3-5-7-20/h2-7,19,21H,1,10-18H2