N-[(1S)-1-(3-chlorophenyl)-2-oxidanyl-ethyl]-4-(5-methyl-2-phenylazanyl-pyrimidin-4-yl)-1H-pyrrole-2-carboxamide

Systemtic Name: N-[(1S)-1-(3-chlorophenyl)-2-oxidanyl-ethyl]-4-(5-methyl-2-phenylazanyl-pyrimidin-4-yl)-1H-pyrrole-2-carboxamide Openeye Name: 4-(2-anilino-5-methyl-pyrimidin-4-yl)-N-[(1S)-1-(3-chlorophenyl)-2-hydroxy-ethyl]-1H-pyrrole-2-carboxamide CAS Name: 4-(2-anilino-5-methyl-4-pyrimidinyl)-N-[(1S)-1-(3-chlorophenyl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-(2-anilino-5-methylpyrimidin-4-yl)-N-[(1S)-1-(3-chlorophenyl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide Traditional Name: 4-(2-anilino-5-methyl-pyrimidin-4-yl)-N-[(1S)-1-(3-chlorophenyl)-2-hydroxy-ethyl]-1H-pyrrole-2-carboxamide Formula: C24H22ClN5O2 MolecularWeight: 447.91678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2=CNC(=C2)C(=O)NC(CO)C3=CC(=CC=C3)Cl)NC4=CC=CC=C4

Isomeric SMILES

CC1=CN=C(N=C1C2=CNC(=C2)C(=O)N[C@H](CO)C3=CC(=CC=C3)Cl)NC4=CC=CC=C4

InChI

InChI=1S/C24H22ClN5O2/c1-15-12-27-24(28-19-8-3-2-4-9-19)30-22(15)17-11-20(26-13-17)23(32)29-21(14-31)16-6-5-7-18(25)10-16/h2-13,21,26,31H,14H2,1H3,(H,29,32)(H,27,28,30)/t21-/m1/s1