5-bromanyl-N-[4-tert-butyl-5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-yl]-2-oxidanyl-benzamide

Systemtic Name: 5-bromanyl-N-[4-tert-butyl-5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-yl]-2-oxidanyl-benzamide Openeye Name: 5-bromo-N-[4-tert-butyl-5-(4-methylpiperazin-1-yl)thiazol-2-yl]-2-hydroxy-benzamide CAS Name: 5-bromo-N-[4-tert-butyl-5-(4-methyl-1-piperazinyl)-2-thiazolyl]-2-hydroxybenzamide IUPAC Name: 5-bromo-N-[4-tert-butyl-5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-yl]-2-hydroxybenzamide Traditional Name: 5-bromo-N-[4-tert-butyl-5-(4-methylpiperazino)thiazol-2-yl]-2-hydroxy-benzamide Formula: C19H25BrN4O2S MolecularWeight: 453.3964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC(=N1)NC(=O)C2=C(C=CC(=C2)Br)O)N3CCN(CC3)C

Isomeric SMILES

CC(C)(C)C1=C(SC(=N1)NC(=O)C2=C(C=CC(=C2)Br)O)N3CCN(CC3)C

InChI

InChI=1S/C19H25BrN4O2S/c1-19(2,3)15-17(24-9-7-23(4)8-10-24)27-18(21-15)22-16(26)13-11-12(20)5-6-14(13)25/h5-6,11,25H,7-10H2,1-4H3,(H,21,22,26)