(2-prop-2-enylsulfanylpyridin-3-yl)-[4-[4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-1,3-thiazol-2-yl]piperidin-1-yl]methanone

Systemtic Name: (2-prop-2-enylsulfanylpyridin-3-yl)-[4-[4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-1,3-thiazol-2-yl]piperidin-1-yl]methanone Openeye Name: (2-allylsulfanyl-3-pyridyl)-[4-[4-[4-(2-pyridyl)piperazine-1-carbonyl]thiazol-2-yl]-1-piperidyl]methanone CAS Name: [4-[4-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-2-thiazolyl]-1-piperidinyl]-[2-(prop-2-enylthio)-3-pyridinyl]methanone IUPAC Name: (2-prop-2-enylsulfanylpyridin-3-yl)-[4-[4-(4-pyridin-2-ylpiperazine-1-carbonyl)-1,3-thiazol-2-yl]piperidin-1-yl]methanone Traditional Name: [2-(allylthio)-3-pyridyl]-[4-[4-[4-(2-pyridyl)piperazine-1-carbonyl]thiazol-2-yl]piperidino]methanone Formula: C27H30N6O2S2 MolecularWeight: 534.6961

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

C=CCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C27H30N6O2S2/c1-2-18-36-25-21(6-5-11-29-25)26(34)32-12-8-20(9-13-32)24-30-22(19-37-24)27(35)33-16-14-31(15-17-33)23-7-3-4-10-28-23/h2-7,10-11,19-20H,1,8-9,12-18H2