4-bromanyl-N-[2-[1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-bromanyl-N-[2-[1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-bromo-N-[2-[2-(4-ethoxyanilino)-1-methyl-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-bromo-N-[2-[[1-(4-ethoxyanilino)-1-oxopropan-2-yl]thio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-bromo-N-[2-[1-(4-ethoxyanilino)-1-oxopropan-2-yl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-bromo-N-[2-[[2-keto-1-methyl-2-(p-phenetidino)ethyl]thio]-1,3-benzothiazol-6-yl]benzamide Formula: C25H22BrN3O3S2 MolecularWeight: 556.49448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H22BrN3O3S2/c1-3-32-20-11-8-18(9-12-20)27-23(30)15(2)33-25-29-21-13-10-19(14-22(21)34-25)28-24(31)16-4-6-17(26)7-5-16/h4-15H,3H2,1-2H3,(H,27,30)(H,28,31)