N-tert-butyl-3-chloranyl-7-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]-1-benzothiophene-2-carboxamide

Systemtic Name: N-tert-butyl-3-chloranyl-7-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]-1-benzothiophene-2-carboxamide Openeye Name: N-tert-butyl-3-chloro-7-[(4-morpholino-3-nitro-benzoyl)amino]benzothiophene-2-carboxamide CAS Name: N-tert-butyl-3-chloro-7-[[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]amino]-1-benzothiophene-2-carboxamide IUPAC Name: N-tert-butyl-3-chloro-7-[(4-morpholin-4-yl-3-nitrobenzoyl)amino]-1-benzothiophene-2-carboxamide Traditional Name: N-tert-butyl-3-chloro-7-[(4-morpholino-3-nitro-benzoyl)amino]benzothiophene-2-carboxamide Formula: C24H25ClN4O5S MolecularWeight: 516.9971

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=C(C2=C(S1)C(=CC=C2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=C(C2=C(S1)C(=CC=C2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])Cl

InChI

InChI=1S/C24H25ClN4O5S/c1-24(2,3)27-23(31)21-19(25)15-5-4-6-16(20(15)35-21)26-22(30)14-7-8-17(18(13-14)29(32)33)28-9-11-34-12-10-28/h4-8,13H,9-12H2,1-3H3,(H,26,30)(H,27,31)