2-(3-azanyl-1,2-benzoxazol-5-yl)-5-ethyl-N-[4-(2-methylimidazol-1-yl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 2-(3-azanyl-1,2-benzoxazol-5-yl)-5-ethyl-N-[4-(2-methylimidazol-1-yl)phenyl]pyrazole-3-carboxamide Openeye Name: 2-(3-amino-1,2-benzoxazol-5-yl)-5-ethyl-N-[4-(2-methylimidazol-1-yl)phenyl]pyrazole-3-carboxamide CAS Name: 2-(3-amino-1,2-benzoxazol-5-yl)-5-ethyl-N-[4-(2-methyl-1-imidazolyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 2-(3-amino-1,2-benzoxazol-5-yl)-5-ethyl-N-[4-(2-methylimidazol-1-yl)phenyl]pyrazole-3-carboxamide Traditional Name: 2-(3-aminoindoxazen-5-yl)-5-ethyl-N-[4-(2-methylimidazol-1-yl)phenyl]pyrazole-3-carboxamide Formula: C23H21N7O2 MolecularWeight: 427.45854

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3C)C4=CC5=C(C=C4)ON=C5N

Isomeric SMILES

CCC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3C)C4=CC5=C(C=C4)ON=C5N

InChI

InChI=1S/C23H21N7O2/c1-3-15-12-20(30(27-15)18-8-9-21-19(13-18)22(24)28-32-21)23(31)26-16-4-6-17(7-5-16)29-11-10-25-14(29)2/h4-13H,3H2,1-2H3,(H2,24,28)(H,26,31)