2-(3-azanyl-1,2-benzoxazol-5-yl)-5-ethyl-N-(2-pyrrolidin-1-yl-4-pyrrolidin-1-ylcarbonyl-phenyl)pyrazole-3-carboxamide

Systemtic Name: 2-(3-azanyl-1,2-benzoxazol-5-yl)-5-ethyl-N-(2-pyrrolidin-1-yl-4-pyrrolidin-1-ylcarbonyl-phenyl)pyrazole-3-carboxamide Openeye Name: 2-(3-amino-1,2-benzoxazol-5-yl)-5-ethyl-N-[4-(pyrrolidine-1-carbonyl)-2-pyrrolidin-1-yl-phenyl]pyrazole-3-carboxamide CAS Name: 2-(3-amino-1,2-benzoxazol-5-yl)-5-ethyl-N-[4-[oxo(1-pyrrolidinyl)methyl]-2-(1-pyrrolidinyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 2-(3-amino-1,2-benzoxazol-5-yl)-5-ethyl-N-[4-(pyrrolidine-1-carbonyl)-2-pyrrolidin-1-ylphenyl]pyrazole-3-carboxamide Traditional Name: 2-(3-aminoindoxazen-5-yl)-5-ethyl-N-[4-(pyrrolidine-1-carbonyl)-2-pyrrolidino-phenyl]pyrazole-3-carboxamide Formula: C28H31N7O3 MolecularWeight: 513.59084

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)C(=O)NC2=C(C=C(C=C2)C(=O)N3CCCC3)N4CCCC4)C5=CC6=C(C=C5)ON=C6N

Isomeric SMILES

CCC1=NN(C(=C1)C(=O)NC2=C(C=C(C=C2)C(=O)N3CCCC3)N4CCCC4)C5=CC6=C(C=C5)ON=C6N

InChI

InChI=1S/C28H31N7O3/c1-2-19-16-24(35(31-19)20-8-10-25-21(17-20)26(29)32-38-25)27(36)30-22-9-7-18(28(37)34-13-5-6-14-34)15-23(22)33-11-3-4-12-33/h7-10,15-17H,2-6,11-14H2,1H3,(H2,29,32)(H,30,36)