5-[5-[[5-tert-butyl-2-[(4-methylpiperazin-1-yl)methyl]phenyl]carbonylamino]-2-methyl-phenyl]-N-piperidin-1-yl-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[5-[[5-tert-butyl-2-[(4-methylpiperazin-1-yl)methyl]phenyl]carbonylamino]-2-methyl-phenyl]-N-piperidin-1-yl-1,2-oxazole-3-carboxamide Openeye Name: 5-[5-[[5-tert-butyl-2-[(4-methylpiperazin-1-yl)methyl]benzoyl]amino]-2-methyl-phenyl]-N-(1-piperidyl)isoxazole-3-carboxamide CAS Name: 5-[5-[[[5-tert-butyl-2-[(4-methyl-1-piperazinyl)methyl]phenyl]-oxomethyl]amino]-2-methylphenyl]-N-(1-piperidinyl)-3-isoxazolecarboxamide IUPAC Name: 5-[5-[[5-tert-butyl-2-[(4-methylpiperazin-1-yl)methyl]benzoyl]amino]-2-methylphenyl]-N-piperidin-1-yl-1,2-oxazole-3-carboxamide Traditional Name: 5-[5-[[5-tert-butyl-2-[(4-methylpiperazino)methyl]benzoyl]amino]-2-methyl-phenyl]-N-piperidino-isoxazole-3-carboxamide Formula: C33H44N6O3 MolecularWeight: 572.74086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)C(C)(C)C)CN3CCN(CC3)C)C4=CC(=NO4)C(=O)NN5CCCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)C(C)(C)C)CN3CCN(CC3)C)C4=CC(=NO4)C(=O)NN5CCCCC5

InChI

InChI=1S/C33H44N6O3/c1-23-9-12-26(20-27(23)30-21-29(36-42-30)32(41)35-39-13-7-6-8-14-39)34-31(40)28-19-25(33(2,3)4)11-10-24(28)22-38-17-15-37(5)16-18-38/h9-12,19-21H,6-8,13-18,22H2,1-5H3,(H,34,40)(H,35,41)