N-[4-[(3R)-3-azanylpiperidin-1-yl]-5-methylsulfanyl-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide

Systemtic Name: N-[4-[(3R)-3-azanylpiperidin-1-yl]-5-methylsulfanyl-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide Openeye Name: N-[4-[(3R)-3-amino-1-piperidyl]-5-methylsulfanyl-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide CAS Name: N-[4-[(3R)-3-amino-1-piperidinyl]-5-(methylthio)-1H-pyrrolo[2,3-b]pyridin-3-yl]-3-pyridinecarboxamide IUPAC Name: N-[4-[(3R)-3-aminopiperidin-1-yl]-5-methylsulfanyl-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide Traditional Name: N-[4-[(3R)-3-aminopiperidino]-5-(methylthio)-1H-pyrrolo[2,3-b]pyridin-3-yl]nicotinamide Formula: C19H22N6OS MolecularWeight: 382.48258

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CN=C2C(=C1N3CCCC(C3)N)C(=CN2)NC(=O)C4=CN=CC=C4

Isomeric SMILES

CSC1=CN=C2C(=C1N3CCC[C@H](C3)N)C(=CN2)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C19H22N6OS/c1-27-15-10-23-18-16(17(15)25-7-3-5-13(20)11-25)14(9-22-18)24-19(26)12-4-2-6-21-8-12/h2,4,6,8-10,13H,3,5,7,11,20H2,1H3,(H,22,23)(H,24,26)/t13-/m1/s1