butyl 2-[[5-(4-bromophenyl)furan-2-yl]carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: butyl 2-[[5-(4-bromophenyl)furan-2-yl]carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-[[5-(4-bromophenyl)furan-2-carbonyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[5-(4-bromophenyl)-2-furanyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-[[5-(4-bromophenyl)furan-2-carbonyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[5-(4-bromophenyl)-2-furoyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C23H19BrN2O4S MolecularWeight: 499.37696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H19BrN2O4S/c1-2-3-12-29-22(28)15-6-9-17-20(13-15)31-23(25-17)26-21(27)19-11-10-18(30-19)14-4-7-16(24)8-5-14/h4-11,13H,2-3,12H2,1H3,(H,25,26,27)