3-[[2-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N,N-bis(2-oxidanylpropyl)benzamide

Systemtic Name: 3-[[2-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N,N-bis(2-oxidanylpropyl)benzamide Openeye Name: N,N-bis(2-hydroxypropyl)-3-[[2-(3-methylanilino)pyrimidin-4-yl]amino]benzamide CAS Name: N,N-bis(2-hydroxypropyl)-3-[[2-(3-methylanilino)-4-pyrimidinyl]amino]benzamide IUPAC Name: N,N-bis(2-hydroxypropyl)-3-[[2-(3-methylanilino)pyrimidin-4-yl]amino]benzamide Traditional Name: N,N-bis(2-hydroxypropyl)-3-[[2-(m-toluidino)pyrimidin-4-yl]amino]benzamide Formula: C24H29N5O3 MolecularWeight: 435.51876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=CC(=N2)NC3=CC=CC(=C3)C(=O)N(CC(C)O)CC(C)O

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=CC(=N2)NC3=CC=CC(=C3)C(=O)N(CC(C)O)CC(C)O

InChI

InChI=1S/C24H29N5O3/c1-16-6-4-8-20(12-16)27-24-25-11-10-22(28-24)26-21-9-5-7-19(13-21)23(32)29(14-17(2)30)15-18(3)31/h4-13,17-18,30-31H,14-15H2,1-3H3,(H2,25,26,27,28)