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

Systemtic Name: butyl 2-[[5-(4-methoxy-2-nitro-phenyl)furan-2-yl]carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-[[5-(4-methoxy-2-nitro-phenyl)furan-2-carbonyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[5-(4-methoxy-2-nitrophenyl)-2-furanyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-[[5-(4-methoxy-2-nitrophenyl)furan-2-carbonyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[5-(4-methoxy-2-nitro-phenyl)-2-furoyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C24H21N3O7S MolecularWeight: 495.50444

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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=C(C=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)C4=C(C=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C24H21N3O7S/c1-3-4-11-33-23(29)14-5-8-17-21(12-14)35-24(25-17)26-22(28)20-10-9-19(34-20)16-7-6-15(32-2)13-18(16)27(30)31/h5-10,12-13H,3-4,11H2,1-2H3,(H,25,26,28)