1-(3-azanyl-1,2-benzoxazol-5-yl)-5-[[5-(2-oxidanylideneazepan-1-yl)-2,3-dihydroindol-1-yl]carbonyl]pyrazole-3-carboxamide

Systemtic Name: 1-(3-azanyl-1,2-benzoxazol-5-yl)-5-[[5-(2-oxidanylideneazepan-1-yl)-2,3-dihydroindol-1-yl]carbonyl]pyrazole-3-carboxamide Openeye Name: 1-(3-amino-1,2-benzoxazol-5-yl)-5-[5-(2-oxoazepan-1-yl)indoline-1-carbonyl]pyrazole-3-carboxamide CAS Name: 1-(3-amino-1,2-benzoxazol-5-yl)-5-[oxo-[5-(2-oxo-1-azepanyl)-2,3-dihydroindol-1-yl]methyl]-3-pyrazolecarboxamide IUPAC Name: 1-(3-amino-1,2-benzoxazol-5-yl)-5-[5-(2-oxoazepan-1-yl)-2,3-dihydroindole-1-carbonyl]pyrazole-3-carboxamide Traditional Name: 1-(3-aminoindoxazen-5-yl)-5-[5-(2-ketoazepan-1-yl)indoline-1-carbonyl]pyrazole-3-carboxamide Formula: C26H25N7O4 MolecularWeight: 499.5212

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)C2=CC3=C(C=C2)N(CC3)C(=O)C4=CC(=NN4C5=CC6=C(C=C5)ON=C6N)C(=O)N

Isomeric SMILES

C1CCC(=O)N(CC1)C2=CC3=C(C=C2)N(CC3)C(=O)C4=CC(=NN4C5=CC6=C(C=C5)ON=C6N)C(=O)N

InChI

InChI=1S/C26H25N7O4/c27-24-18-13-17(6-8-22(18)37-30-24)33-21(14-19(29-33)25(28)35)26(36)32-11-9-15-12-16(5-7-20(15)32)31-10-3-1-2-4-23(31)34/h5-8,12-14H,1-4,9-11H2,(H2,27,30)(H2,28,35)