2-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]ethanoylamino]-N-(4-bromanyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]ethanoylamino]-N-(4-bromanyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[[2-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]acetyl]amino]-N-(4-bromo-2-methyl-phenyl)acetamide CAS Name: 2-[[2-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-1-oxoethyl]amino]-N-(4-bromo-2-methylphenyl)acetamide IUPAC Name: 2-[[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]acetyl]amino]-N-(4-bromo-2-methylphenyl)acetamide Traditional Name: 2-[[2-[4-(1,3-benzothiazol-2-yl)piperidino]acetyl]amino]-N-(4-bromo-2-methyl-phenyl)acetamide Formula: C23H25BrN4O2S MolecularWeight: 501.4392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CN2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CN2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H25BrN4O2S/c1-15-12-17(24)6-7-18(15)26-21(29)13-25-22(30)14-28-10-8-16(9-11-28)23-27-19-4-2-3-5-20(19)31-23/h2-7,12,16H,8-11,13-14H2,1H3,(H,25,30)(H,26,29)