(2S)-4-(phenylcarbonyl)-1-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazine-2-carboxamide

Systemtic Name: (2S)-4-(phenylcarbonyl)-1-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazine-2-carboxamide Openeye Name: (2S)-4-benzoyl-1-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazine-2-carboxamide CAS Name: (2S)-4-benzoyl-1-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)-2-piperazinecarboxamide IUPAC Name: (2S)-4-benzoyl-1-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazine-2-carboxamide Traditional Name: (2S)-4-benzoyl-1-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazine-2-carboxamide Formula: C19H19N5O4S MolecularWeight: 413.45026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)C2=CC=CC=C2)C(=O)N)S(=O)(=O)C3=CNC4=C3C=CC=N4

Isomeric SMILES

C1CN([C@@H](CN1C(=O)C2=CC=CC=C2)C(=O)N)S(=O)(=O)C3=CNC4=C3C=CC=N4

InChI

InChI=1S/C19H19N5O4S/c20-17(25)15-12-23(19(26)13-5-2-1-3-6-13)9-10-24(15)29(27,28)16-11-22-18-14(16)7-4-8-21-18/h1-8,11,15H,9-10,12H2,(H2,20,25)(H,21,22)/t15-/m0/s1