N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-9H-xanthene-9-carboxamide Openeye Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-9H-xanthene-9-carboxamide CAS Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-9H-xanthene-9-carboxamide Traditional Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-9H-xanthene-9-carboxamide Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NCCCC4=C(C(=NN4)N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NCCCC4=C(C(=NN4)N)C#N

InChI

InChI=1S/C21H19N5O2/c22-12-15-16(25-26-20(15)23)8-5-11-24-21(27)19-13-6-1-3-9-17(13)28-18-10-4-2-7-14(18)19/h1-4,6-7,9-10,19H,5,8,11H2,(H,24,27)(H3,23,25,26)