[4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)methanone

Systemtic Name: [4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)methanone Openeye Name: [4-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]-1-piperidyl]-(5-chloro-2-methylsulfanyl-pyrimidin-4-yl)methanone CAS Name: [4-[4-(4-bromophenyl)-5-methyl-2-thiazolyl]-1-piperidinyl]-[5-chloro-2-(methylthio)-4-pyrimidinyl]methanone IUPAC Name: [4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]-(5-chloro-2-methylsulfanylpyrimidin-4-yl)methanone Traditional Name: [4-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]piperidino]-[5-chloro-2-(methylthio)pyrimidin-4-yl]methanone Formula: C21H20BrClN4OS2 MolecularWeight: 523.8967

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2CCN(CC2)C(=O)C3=NC(=NC=C3Cl)SC)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(N=C(S1)C2CCN(CC2)C(=O)C3=NC(=NC=C3Cl)SC)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H20BrClN4OS2/c1-12-17(13-3-5-15(22)6-4-13)25-19(30-12)14-7-9-27(10-8-14)20(28)18-16(23)11-24-21(26-18)29-2/h3-6,11,14H,7-10H2,1-2H3