N-[2-[(1,3-diphenylpyrazol-4-yl)methylamino]-2-oxidanylidene-ethyl]-4-ethoxy-benzamide

Systemtic Name: N-[2-[(1,3-diphenylpyrazol-4-yl)methylamino]-2-oxidanylidene-ethyl]-4-ethoxy-benzamide Openeye Name: N-[2-[(1,3-diphenylpyrazol-4-yl)methylamino]-2-oxo-ethyl]-4-ethoxy-benzamide CAS Name: N-[2-[(1,3-diphenyl-4-pyrazolyl)methylamino]-2-oxoethyl]-4-ethoxybenzamide IUPAC Name: N-[2-[(1,3-diphenylpyrazol-4-yl)methylamino]-2-oxoethyl]-4-ethoxybenzamide Traditional Name: N-[2-[(1,3-diphenylpyrazol-4-yl)methylamino]-2-keto-ethyl]-4-ethoxy-benzamide Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCC(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCC(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O3/c1-2-34-24-15-13-21(14-16-24)27(33)29-18-25(32)28-17-22-19-31(23-11-7-4-8-12-23)30-26(22)20-9-5-3-6-10-20/h3-16,19H,2,17-18H2,1H3,(H,28,32)(H,29,33)