N-[3-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-3-oxidanylidene-propyl]-2-methoxy-benzamide

Systemtic Name: N-[3-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-3-oxidanylidene-propyl]-2-methoxy-benzamide Openeye Name: N-[3-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-3-oxo-propyl]-2-methoxy-benzamide CAS Name: N-[3-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propylamino]-3-oxopropyl]-2-methoxybenzamide IUPAC Name: N-[3-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propylamino]-3-oxopropyl]-2-methoxybenzamide Traditional Name: N-[3-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-3-keto-propyl]-2-methoxy-benzamide Formula: C24H26N6O3 MolecularWeight: 446.50164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCCC(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCCC(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3

InChI

InChI=1S/C24H26N6O3/c1-33-21-12-6-5-10-18(21)24(32)28-15-13-22(31)27-14-7-11-20-19(16-25)23(26)30(29-20)17-8-3-2-4-9-17/h2-6,8-10,12H,7,11,13-15,26H2,1H3,(H,27,31)(H,28,32)