5-chloranyl-N-[(2S)-1-oxidanylidene-3-phenyl-1-thiomorpholin-4-yl-propan-2-yl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide

Systemtic Name: 5-chloranyl-N-[(2S)-1-oxidanylidene-3-phenyl-1-thiomorpholin-4-yl-propan-2-yl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-oxo-2-thiomorpholino-ethyl]-5-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide CAS Name: 5-chloro-N-[(2S)-1-oxo-3-phenyl-1-thiomorpholin-4-ylpropan-2-yl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide IUPAC Name: 5-chloro-N-[(2S)-1-oxo-3-phenyl-1-thiomorpholin-4-ylpropan-2-yl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-thiomorpholino-ethyl]-5-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide Formula: C21H21ClN4O2S MolecularWeight: 428.93504

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC4=CC(=NC=C4N3)Cl

Isomeric SMILES

C1CSCCN1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CC4=CC(=NC=C4N3)Cl

InChI

InChI=1S/C21H21ClN4O2S/c22-19-12-15-11-16(24-18(15)13-23-19)20(27)25-17(10-14-4-2-1-3-5-14)21(28)26-6-8-29-9-7-26/h1-5,11-13,17,24H,6-10H2,(H,25,27)/t17-/m0/s1