1-[4-[2-[(5-bromanyl-3-phenylsulfanyl-pyridin-2-yl)amino]-1,3-thiazol-4-yl]piperidin-1-yl]ethanone

Systemtic Name: 1-[4-[2-[(5-bromanyl-3-phenylsulfanyl-pyridin-2-yl)amino]-1,3-thiazol-4-yl]piperidin-1-yl]ethanone Openeye Name: 1-[4-[2-[(5-bromo-3-phenylsulfanyl-2-pyridyl)amino]thiazol-4-yl]-1-piperidyl]ethanone CAS Name: 1-[4-[2-[[5-bromo-3-(phenylthio)-2-pyridinyl]amino]-4-thiazolyl]-1-piperidinyl]ethanone IUPAC Name: 1-[4-[2-[(5-bromo-3-phenylsulfanylpyridin-2-yl)amino]-1,3-thiazol-4-yl]piperidin-1-yl]ethanone Traditional Name: 1-[4-[2-[[5-bromo-3-(phenylthio)-2-pyridyl]amino]thiazol-4-yl]piperidino]ethanone Formula: C21H21BrN4OS2 MolecularWeight: 489.45164

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C2=CSC(=N2)NC3=NC=C(C=C3SC4=CC=CC=C4)Br

Isomeric SMILES

CC(=O)N1CCC(CC1)C2=CSC(=N2)NC3=NC=C(C=C3SC4=CC=CC=C4)Br

InChI

InChI=1S/C21H21BrN4OS2/c1-14(27)26-9-7-15(8-10-26)18-13-28-21(24-18)25-20-19(11-16(22)12-23-20)29-17-5-3-2-4-6-17/h2-6,11-13,15H,7-10H2,1H3,(H,23,24,25)