4-(2-azanylpyrimidin-4-yl)-N-[(1S)-1-(3-methylphenyl)-2-oxidanyl-ethyl]benzamide

Systemtic Name: 4-(2-azanylpyrimidin-4-yl)-N-[(1S)-1-(3-methylphenyl)-2-oxidanyl-ethyl]benzamide Openeye Name: 4-(2-aminopyrimidin-4-yl)-N-[(1S)-2-hydroxy-1-(m-tolyl)ethyl]benzamide CAS Name: 4-(2-amino-4-pyrimidinyl)-N-[(1S)-2-hydroxy-1-(3-methylphenyl)ethyl]benzamide IUPAC Name: 4-(2-aminopyrimidin-4-yl)-N-[(1S)-2-hydroxy-1-(3-methylphenyl)ethyl]benzamide Traditional Name: 4-(2-aminopyrimidin-4-yl)-N-[(1S)-2-hydroxy-1-(m-tolyl)ethyl]benzamide Formula: C20H20N4O2 MolecularWeight: 348.3984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CO)NC(=O)C2=CC=C(C=C2)C3=NC(=NC=C3)N

Isomeric SMILES

CC1=CC(=CC=C1)[C@@H](CO)NC(=O)C2=CC=C(C=C2)C3=NC(=NC=C3)N

InChI

InChI=1S/C20H20N4O2/c1-13-3-2-4-16(11-13)18(12-25)23-19(26)15-7-5-14(6-8-15)17-9-10-22-20(21)24-17/h2-11,18,25H,12H2,1H3,(H,23,26)(H2,21,22,24)/t18-/m1/s1