3-[[6-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N-(3-oxidanylpropyl)benzamide

Systemtic Name: 3-[[6-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N-(3-oxidanylpropyl)benzamide Openeye Name: N-(3-hydroxypropyl)-3-[[6-(3-methylanilino)pyrimidin-4-yl]amino]benzamide CAS Name: N-(3-hydroxypropyl)-3-[[6-(3-methylanilino)-4-pyrimidinyl]amino]benzamide IUPAC Name: N-(3-hydroxypropyl)-3-[[6-(3-methylanilino)pyrimidin-4-yl]amino]benzamide Traditional Name: N-(3-hydroxypropyl)-3-[[6-(m-toluidino)pyrimidin-4-yl]amino]benzamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=NC(=C2)NC3=CC=CC(=C3)C(=O)NCCCO

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC(=C2)NC3=CC=CC(=C3)C(=O)NCCCO

InChI

InChI=1S/C21H23N5O2/c1-15-5-2-7-17(11-15)25-19-13-20(24-14-23-19)26-18-8-3-6-16(12-18)21(28)22-9-4-10-27/h2-3,5-8,11-14,27H,4,9-10H2,1H3,(H,22,28)(H2,23,24,25,26)