[4-[2-(3-azanyl-1,2-benzoxazol-5-yl)-5-ethyl-pyrazol-3-yl]phenyl]-pyrrolidin-2-yl-methanone

Systemtic Name: [4-[2-(3-azanyl-1,2-benzoxazol-5-yl)-5-ethyl-pyrazol-3-yl]phenyl]-pyrrolidin-2-yl-methanone Openeye Name: [4-[2-(3-amino-1,2-benzoxazol-5-yl)-5-ethyl-pyrazol-3-yl]phenyl]-pyrrolidin-2-yl-methanone CAS Name: [4-[2-(3-amino-1,2-benzoxazol-5-yl)-5-ethyl-3-pyrazolyl]phenyl]-(2-pyrrolidinyl)methanone IUPAC Name: [4-[2-(3-amino-1,2-benzoxazol-5-yl)-5-ethylpyrazol-3-yl]phenyl]-pyrrolidin-2-ylmethanone Traditional Name: [4-[2-(3-aminoindoxazen-5-yl)-5-ethyl-pyrazol-3-yl]phenyl]-pyrrolidin-2-yl-methanone Formula: C23H23N5O2 MolecularWeight: 401.46102

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)C2=CC=C(C=C2)C(=O)C3CCCN3)C4=CC5=C(C=C4)ON=C5N

Isomeric SMILES

CCC1=NN(C(=C1)C2=CC=C(C=C2)C(=O)C3CCCN3)C4=CC5=C(C=C4)ON=C5N

InChI

InChI=1S/C23H23N5O2/c1-2-16-12-20(14-5-7-15(8-6-14)22(29)19-4-3-11-25-19)28(26-16)17-9-10-21-18(13-17)23(24)27-30-21/h5-10,12-13,19,25H,2-4,11H2,1H3,(H2,24,27)