4-azanyl-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)-3,4-dihydro-2H-thiochromene-7-carboxamide

Systemtic Name: 4-azanyl-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)-3,4-dihydro-2H-thiochromene-7-carboxamide Openeye Name: 4-amino-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiochromane-7-carboxamide CAS Name: 4-amino-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)-3,4-dihydro-2H-1-benzothiopyran-7-carboxamide IUPAC Name: 4-amino-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)-3,4-dihydro-2H-thiochromene-7-carboxamide Traditional Name: 4-amino-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiochroman-7-carboxamide Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1N)C=CC(=C2)C(=O)NC3=C4C=CNC4=NC=C3

Isomeric SMILES

C1CSC2=C(C1N)C=CC(=C2)C(=O)NC3=C4C=CNC4=NC=C3

InChI

InChI=1S/C17H16N4OS/c18-13-5-8-23-15-9-10(1-2-11(13)15)17(22)21-14-4-7-20-16-12(14)3-6-19-16/h1-4,6-7,9,13H,5,8,18H2,(H2,19,20,21,22)