N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-4-methyl-3-pyrrol-1-yl-benzamide

Systemtic Name: N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-4-methyl-3-pyrrol-1-yl-benzamide Openeye Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-4-methyl-3-pyrrol-1-yl-benzamide CAS Name: N-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propyl]-4-methyl-3-(1-pyrrolyl)benzamide IUPAC Name: N-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propyl]-4-methyl-3-pyrrol-1-ylbenzamide Traditional Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-4-methyl-3-pyrrol-1-yl-benzamide Formula: C25H24N6O MolecularWeight: 424.49766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C25H24N6O/c1-18-11-12-19(16-23(18)30-14-5-6-15-30)25(32)28-13-7-10-22-21(17-26)24(27)31(29-22)20-8-3-2-4-9-20/h2-6,8-9,11-12,14-16H,7,10,13,27H2,1H3,(H,28,32)