N-[1-(3-chlorophenyl)-2-oxidanyl-ethyl]-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide

Systemtic Name: N-[1-(3-chlorophenyl)-2-oxidanyl-ethyl]-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide Openeye Name: N-[1-(3-chlorophenyl)-2-hydroxy-ethyl]-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide CAS Name: N-[1-(3-chlorophenyl)-2-hydroxyethyl]-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide IUPAC Name: N-[1-(3-chlorophenyl)-2-hydroxyethyl]-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide Traditional Name: N-[1-(3-chlorophenyl)-2-hydroxy-ethyl]-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrrole-2-carboxamide Formula: C19H16ClN5O2 MolecularWeight: 381.81564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(CO)NC(=O)C2=CC(=CN2)C3=C4C=CNC4=NC=N3

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(CO)NC(=O)C2=CC(=CN2)C3=C4C=CNC4=NC=N3

InChI

InChI=1S/C19H16ClN5O2/c20-13-3-1-2-11(6-13)16(9-26)25-19(27)15-7-12(8-22-15)17-14-4-5-21-18(14)24-10-23-17/h1-8,10,16,22,26H,9H2,(H,25,27)(H,21,23,24)