N-[4-acetamido-4-[[4-(diethylamino)phenyl]amino]-5-oxidanylidene-1-phenyl-pyrazol-3-yl]-4-chloranyl-benzamide

Systemtic Name: N-[4-acetamido-4-[[4-(diethylamino)phenyl]amino]-5-oxidanylidene-1-phenyl-pyrazol-3-yl]-4-chloranyl-benzamide Openeye Name: N-[4-acetamido-4-[4-(diethylamino)anilino]-5-oxo-1-phenyl-pyrazol-3-yl]-4-chloro-benzamide CAS Name: N-[4-acetamido-4-[4-(diethylamino)anilino]-5-oxo-1-phenyl-3-pyrazolyl]-4-chlorobenzamide IUPAC Name: N-[4-acetamido-4-[4-(diethylamino)anilino]-5-oxo-1-phenylpyrazol-3-yl]-4-chlorobenzamide Traditional Name: N-[4-acetamido-4-[4-(diethylamino)anilino]-5-keto-1-phenyl-2-pyrazolin-3-yl]-4-chloro-benzamide Formula: C28H29ClN6O3 MolecularWeight: 533.02126

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC2(C(=NN(C2=O)C3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)Cl)NC(=O)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC2(C(=NN(C2=O)C3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)Cl)NC(=O)C

InChI

InChI=1S/C28H29ClN6O3/c1-4-34(5-2)23-17-15-22(16-18-23)32-28(31-19(3)36)26(30-25(37)20-11-13-21(29)14-12-20)33-35(27(28)38)24-9-7-6-8-10-24/h6-18,32H,4-5H2,1-3H3,(H,31,36)(H,30,33,37)