N-ethylethanamine; 4-methyl-N-(5-oxidanylidene-1,3-diphenyl-4-phenylazanyl-pyrazol-4-yl)benzamide

Systemtic Name: N-ethylethanamine; 4-methyl-N-(5-oxidanylidene-1,3-diphenyl-4-phenylazanyl-pyrazol-4-yl)benzamide Openeye Name: N-(4-anilino-5-oxo-1,3-diphenyl-pyrazol-4-yl)-4-methyl-benzamide; N-ethylethanamine CAS Name: N-(4-anilino-5-oxo-1,3-diphenyl-4-pyrazolyl)-4-methylbenzamide; N-ethylethanamine IUPAC Name: N-(4-anilino-5-oxo-1,3-diphenylpyrazol-4-yl)-4-methylbenzamide; N-ethylethanamine Traditional Name: N-(4-anilino-5-keto-1,3-diphenyl-2-pyrazolin-4-yl)-4-methyl-benzamide; diethylamine Formula: C33H35N5O2 MolecularWeight: 533.6633

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC.CC1=CC=C(C=C1)C(=O)NC2(C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)NC5=CC=CC=C5

Isomeric SMILES

CCNCC.CC1=CC=C(C=C1)C(=O)NC2(C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)NC5=CC=CC=C5

InChI

InChI=1S/C29H24N4O2.C4H11N/c1-21-17-19-23(20-18-21)27(34)31-29(30-24-13-7-3-8-14-24)26(22-11-5-2-6-12-22)32-33(28(29)35)25-15-9-4-10-16-25;1-3-5-4-2/h2-20,30H,1H3,(H,31,34);5H,3-4H2,1-2H3