3-[(Z)-2-cyano-3-(dimethylamino)prop-2-enoyl]-1,5-diphenyl-pyrazole-4-carbonitrile

Systemtic Name: 3-[(Z)-2-cyano-3-(dimethylamino)prop-2-enoyl]-1,5-diphenyl-pyrazole-4-carbonitrile Openeye Name: 3-[(Z)-2-cyano-3-(dimethylamino)prop-2-enoyl]-1,5-diphenyl-pyrazole-4-carbonitrile CAS Name: 3-[(Z)-2-cyano-3-(dimethylamino)-1-oxoprop-2-enyl]-1,5-diphenyl-4-pyrazolecarbonitrile IUPAC Name: 3-[(Z)-2-cyano-3-(dimethylamino)prop-2-enoyl]-1,5-diphenylpyrazole-4-carbonitrile Traditional Name: 3-[(Z)-2-cyano-3-(dimethylamino)acryloyl]-1,5-diphenyl-pyrazole-4-carbonitrile Formula: C22H17N5O MolecularWeight: 367.40328

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=C(C#N)C(=O)C1=NN(C(=C1C#N)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CN(C)/C=C(/C#N)\C(=O)C1=NN(C(=C1C#N)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H17N5O/c1-26(2)15-17(13-23)22(28)20-19(14-24)21(16-9-5-3-6-10-16)27(25-20)18-11-7-4-8-12-18/h3-12,15H,1-2H3/b17-15-