N-[3-[(E)-3-azanyl-2-cyano-3-sulfanylidene-prop-1-enyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-3-piperidin-1-yl-propanamide

Systemtic Name: N-[3-[(E)-3-azanyl-2-cyano-3-sulfanylidene-prop-1-enyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-3-piperidin-1-yl-propanamide Openeye Name: N-[3-[(E)-3-amino-2-cyano-3-thioxo-prop-1-enyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-3-(1-piperidyl)propanamide CAS Name: N-[3-[(E)-3-amino-2-cyano-3-sulfanylideneprop-1-enyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-3-(1-piperidinyl)propanamide IUPAC Name: N-[3-[(E)-3-amino-2-cyano-3-sulfanylideneprop-1-enyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-3-piperidin-1-ylpropanamide Traditional Name: N-[3-[(E)-3-amino-2-cyano-3-thioxo-prop-1-enyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-3-piperidino-propionamide Formula: C19H22N6OS MolecularWeight: 382.48258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC(=O)NC2=C3C(=CNC3=NC=C2)C=C(C#N)C(=S)N

Isomeric SMILES

C1CCN(CC1)CCC(=O)NC2=C3C(=CNC3=NC=C2)/C=C(\C#N)/C(=S)N

InChI

InChI=1S/C19H22N6OS/c20-11-13(18(21)27)10-14-12-23-19-17(14)15(4-6-22-19)24-16(26)5-9-25-7-2-1-3-8-25/h4,6,10,12H,1-3,5,7-9H2,(H2,21,27)(H2,22,23,24,26)/b13-10+