N-[6-[(3-bromanyl-4-methoxy-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide

Systemtic Name: N-[6-[(3-bromanyl-4-methoxy-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Openeye Name: N-[6-[(3-bromo-4-methoxy-benzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide CAS Name: N-[6-[[(3-bromo-4-methoxyphenyl)-oxomethyl]amino]-1,3-benzothiazol-2-yl]-2-furancarboxamide IUPAC Name: N-[6-[(3-bromo-4-methoxybenzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Traditional Name: N-[6-[(3-bromo-4-methoxy-benzoyl)amino]-1,3-benzothiazol-2-yl]-2-furamide Formula: C20H14BrN3O4S MolecularWeight: 472.31186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=CO4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=CO4)Br

InChI

InChI=1S/C20H14BrN3O4S/c1-27-15-7-4-11(9-13(15)21)18(25)22-12-5-6-14-17(10-12)29-20(23-14)24-19(26)16-3-2-8-28-16/h2-10H,1H3,(H,22,25)(H,23,24,26)