N-[1,2-bis(oxidanyl)-2-phenyl-ethyl]-4-(6-chloranylpyrimidin-4-yl)-5-methyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[1,2-bis(oxidanyl)-2-phenyl-ethyl]-4-(6-chloranylpyrimidin-4-yl)-5-methyl-1H-pyrrole-2-carboxamide Openeye Name: 4-(6-chloropyrimidin-4-yl)-N-(1,2-dihydroxy-2-phenyl-ethyl)-5-methyl-1H-pyrrole-2-carboxamide CAS Name: 4-(6-chloro-4-pyrimidinyl)-N-(1,2-dihydroxy-2-phenylethyl)-5-methyl-1H-pyrrole-2-carboxamide IUPAC Name: 4-(6-chloropyrimidin-4-yl)-N-(1,2-dihydroxy-2-phenylethyl)-5-methyl-1H-pyrrole-2-carboxamide Traditional Name: 4-(6-chloropyrimidin-4-yl)-N-(1,2-dihydroxy-2-phenyl-ethyl)-5-methyl-1H-pyrrole-2-carboxamide Formula: C18H17ClN4O3 MolecularWeight: 372.80558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1)C(=O)NC(C(C2=CC=CC=C2)O)O)C3=CC(=NC=N3)Cl

Isomeric SMILES

CC1=C(C=C(N1)C(=O)NC(C(C2=CC=CC=C2)O)O)C3=CC(=NC=N3)Cl

InChI

InChI=1S/C18H17ClN4O3/c1-10-12(13-8-15(19)21-9-20-13)7-14(22-10)17(25)23-18(26)16(24)11-5-3-2-4-6-11/h2-9,16,18,22,24,26H,1H3,(H,23,25)