N-(2-dimethylaminoethyl)-2-[3-methyl-1-(triphenylmethyl)pyrazol-4-yl]-4-quinolin-4-yl-piperazine-1-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-2-[3-methyl-1-(triphenylmethyl)pyrazol-4-yl]-4-quinolin-4-yl-piperazine-1-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-2-(3-methyl-1-trityl-pyrazol-4-yl)-4-(4-quinolyl)piperazine-1-carboxamide CAS Name: N-(2-dimethylaminoethyl)-2-[3-methyl-1-(triphenylmethyl)-4-pyrazolyl]-4-(4-quinolinyl)-1-piperazinecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-2-(3-methyl-1-tritylpyrazol-4-yl)-4-quinolin-4-ylpiperazine-1-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-2-(3-methyl-1-trityl-pyrazol-4-yl)-4-(4-quinolyl)piperazine-1-carboxamide Formula: C41H43N7O MolecularWeight: 649.82642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2CN(CCN2C(=O)NCCN(C)C)C3=CC=NC4=CC=CC=C43)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

CC1=NN(C=C1C2CN(CCN2C(=O)NCCN(C)C)C3=CC=NC4=CC=CC=C43)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C41H43N7O/c1-31-36(29-48(44-31)41(32-15-7-4-8-16-32,33-17-9-5-10-18-33)34-19-11-6-12-20-34)39-30-46(27-28-47(39)40(49)43-25-26-45(2)3)38-23-24-42-37-22-14-13-21-35(37)38/h4-24,29,39H,25-28,30H2,1-3H3,(H,43,49)