N-[6-[(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide

Systemtic Name: N-[6-[(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Openeye Name: N-[6-[(5-bromo-2-methoxy-3-methyl-benzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide CAS Name: N-[6-[[(5-bromo-2-methoxy-3-methylphenyl)-oxomethyl]amino]-1,3-benzothiazol-2-yl]-2-furancarboxamide IUPAC Name: N-[6-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Traditional Name: N-[6-[(5-bromo-2-methoxy-3-methyl-benzoyl)amino]-1,3-benzothiazol-2-yl]-2-furamide Formula: C21H16BrN3O4S MolecularWeight: 486.33844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=CO4)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=CO4)OC

InChI

InChI=1S/C21H16BrN3O4S/c1-11-8-12(22)9-14(18(11)28-2)19(26)23-13-5-6-15-17(10-13)30-21(24-15)25-20(27)16-4-3-7-29-16/h3-10H,1-2H3,(H,23,26)(H,24,25,27)