N-[3-(1,3-benzothiazol-2-yl)-4-chloranyl-phenyl]-5-bromanyl-2-methoxy-3-methyl-benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)-4-chloranyl-phenyl]-5-bromanyl-2-methoxy-3-methyl-benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-4-chloro-phenyl]-5-bromo-2-methoxy-3-methyl-benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-5-bromo-2-methoxy-3-methylbenzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-5-bromo-2-methoxy-3-methylbenzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-4-chloro-phenyl]-5-bromo-2-methoxy-3-methyl-benzamide Formula: C22H16BrClN2O2S MolecularWeight: 487.79664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC2=CC(=C(C=C2)Cl)C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC2=CC(=C(C=C2)Cl)C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C22H16BrClN2O2S/c1-12-9-13(23)10-16(20(12)28-2)21(27)25-14-7-8-17(24)15(11-14)22-26-18-5-3-4-6-19(18)29-22/h3-11H,1-2H3,(H,25,27)