4-butoxy-N-[4-[[4-[(4-methoxyphenyl)amino]-6-methyl-pyrimidin-2-yl]amino]phenyl]benzamide

Systemtic Name: 4-butoxy-N-[4-[[4-[(4-methoxyphenyl)amino]-6-methyl-pyrimidin-2-yl]amino]phenyl]benzamide Openeye Name: 4-butoxy-N-[4-[[4-(4-methoxyanilino)-6-methyl-pyrimidin-2-yl]amino]phenyl]benzamide CAS Name: 4-butoxy-N-[4-[[4-(4-methoxyanilino)-6-methyl-2-pyrimidinyl]amino]phenyl]benzamide IUPAC Name: 4-butoxy-N-[4-[[4-(4-methoxyanilino)-6-methylpyrimidin-2-yl]amino]phenyl]benzamide Traditional Name: 4-butoxy-N-[4-[[4-methyl-6-(p-anisidino)pyrimidin-2-yl]amino]phenyl]benzamide Formula: C29H31N5O3 MolecularWeight: 497.58814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC3=NC(=CC(=N3)NC4=CC=C(C=C4)OC)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC3=NC(=CC(=N3)NC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C29H31N5O3/c1-4-5-18-37-26-14-6-21(7-15-26)28(35)32-23-8-10-24(11-9-23)33-29-30-20(2)19-27(34-29)31-22-12-16-25(36-3)17-13-22/h6-17,19H,4-5,18H2,1-3H3,(H,32,35)(H2,30,31,33,34)