3-(1,3-diphenylpyrazol-4-yl)-2-[(2-methyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile

Systemtic Name: 3-(1,3-diphenylpyrazol-4-yl)-2-[(2-methyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile Openeye Name: 3-(1,3-diphenylpyrazol-4-yl)-2-(2-methyl-1H-indole-3-carbonyl)prop-2-enenitrile CAS Name: 3-(1,3-diphenyl-4-pyrazolyl)-2-[(2-methyl-1H-indol-3-yl)-oxomethyl]-2-propenenitrile IUPAC Name: 3-(1,3-diphenylpyrazol-4-yl)-2-(2-methyl-1H-indole-3-carbonyl)prop-2-enenitrile Traditional Name: 3-(1,3-diphenylpyrazol-4-yl)-2-(2-methyl-1H-indole-3-carbonyl)acrylonitrile Formula: C28H20N4O MolecularWeight: 428.4846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(=CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C(=CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C28H20N4O/c1-19-26(24-14-8-9-15-25(24)30-19)28(33)21(17-29)16-22-18-32(23-12-6-3-7-13-23)31-27(22)20-10-4-2-5-11-20/h2-16,18,30H,1H3