(2-prop-2-enylsulfanylpyridin-3-yl)-[4-[4-(4-pyrazin-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-pyrazin-2-ylpiperazin-1-yl)carbonyl-1,3-thiazol-2-yl]piperidin-1-yl]methanone Openeye Name: (2-allylsulfanyl-3-pyridyl)-[4-[4-(4-pyrazin-2-ylpiperazine-1-carbonyl)thiazol-2-yl]-1-piperidyl]methanone CAS Name: [4-[4-[oxo-[4-(2-pyrazinyl)-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-pyrazin-2-ylpiperazine-1-carbonyl)-1,3-thiazol-2-yl]piperidin-1-yl]methanone Traditional Name: [2-(allylthio)-3-pyridyl]-[4-[4-(4-pyrazin-2-ylpiperazine-1-carbonyl)thiazol-2-yl]piperidino]methanone Formula: C26H29N7O2S2 MolecularWeight: 535.68416

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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=NC=CN=C5

Isomeric SMILES

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

InChI

InChI=1S/C26H29N7O2S2/c1-2-16-36-24-20(4-3-7-29-24)25(34)32-10-5-19(6-11-32)23-30-21(18-37-23)26(35)33-14-12-31(13-15-33)22-17-27-8-9-28-22/h2-4,7-9,17-19H,1,5-6,10-16H2