propan-2-yl 2-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: propan-2-yl 2-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: isopropyl 2-[[3-nitro-4-(1-piperidyl)benzoyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(3-nitro-4-piperidin-1-ylbenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(3-nitro-4-piperidino-benzoyl)amino]-1,3-benzothiazole-6-carboxylic acid isopropyl ester Formula: C23H24N4O5S MolecularWeight: 468.52546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O5S/c1-14(2)32-22(29)16-6-8-17-20(13-16)33-23(24-17)25-21(28)15-7-9-18(19(12-15)27(30)31)26-10-4-3-5-11-26/h6-9,12-14H,3-5,10-11H2,1-2H3,(H,24,25,28)