(E)-2-cyano-N-(2-dimethylaminoethyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide hydrochloride

Systemtic Name: (E)-2-cyano-N-(2-dimethylaminoethyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide hydrochloride Openeye Name: (E)-2-cyano-N-(2-dimethylaminoethyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide hydrochloride CAS Name: (E)-2-cyano-N-(2-dimethylaminoethyl)-3-(1,3-diphenyl-4-pyrazolyl)-2-propenamide hydrochloride IUPAC Name: (E)-2-cyano-N-(2-dimethylaminoethyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide hydrochloride Traditional Name: (E)-2-cyano-N-(2-dimethylaminoethyl)-3-(1,3-diphenylpyrazol-4-yl)acrylamide hydrochloride Formula: C23H24ClN5O MolecularWeight: 421.92256

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C(=CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C#N.Cl

Isomeric SMILES

CN(C)CCNC(=O)/C(=C/C1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)/C#N.Cl

InChI

InChI=1S/C23H23N5O.ClH/c1-27(2)14-13-25-23(29)19(16-24)15-20-17-28(21-11-7-4-8-12-21)26-22(20)18-9-5-3-6-10-18;/h3-12,15,17H,13-14H2,1-2H3,(H,25,29);1H/b19-15+;