N-[(1S)-1-(3-chlorophenyl)-2-oxidanyl-ethyl]-3,5-dimethyl-4-(2-piperidin-1-ylpyrimidin-4-yl)-1H-pyrrole-2-carboxamide

Systemtic Name: N-[(1S)-1-(3-chlorophenyl)-2-oxidanyl-ethyl]-3,5-dimethyl-4-(2-piperidin-1-ylpyrimidin-4-yl)-1H-pyrrole-2-carboxamide Openeye Name: N-[(1S)-1-(3-chlorophenyl)-2-hydroxy-ethyl]-3,5-dimethyl-4-[2-(1-piperidyl)pyrimidin-4-yl]-1H-pyrrole-2-carboxamide CAS Name: N-[(1S)-1-(3-chlorophenyl)-2-hydroxyethyl]-3,5-dimethyl-4-[2-(1-piperidinyl)-4-pyrimidinyl]-1H-pyrrole-2-carboxamide IUPAC Name: N-[(1S)-1-(3-chlorophenyl)-2-hydroxyethyl]-3,5-dimethyl-4-(2-piperidin-1-ylpyrimidin-4-yl)-1H-pyrrole-2-carboxamide Traditional Name: N-[(1S)-1-(3-chlorophenyl)-2-hydroxy-ethyl]-3,5-dimethyl-4-(2-piperidinopyrimidin-4-yl)-1H-pyrrole-2-carboxamide Formula: C24H28ClN5O2 MolecularWeight: 453.96442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C2=NC(=NC=C2)N3CCCCC3)C)C(=O)NC(CO)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(NC(=C1C2=NC(=NC=C2)N3CCCCC3)C)C(=O)N[C@H](CO)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H28ClN5O2/c1-15-21(19-9-10-26-24(29-19)30-11-4-3-5-12-30)16(2)27-22(15)23(32)28-20(14-31)17-7-6-8-18(25)13-17/h6-10,13,20,27,31H,3-5,11-12,14H2,1-2H3,(H,28,32)/t20-/m1/s1