3-azanyl-4-[4-(5-ethanoylpyridin-2-yl)-1,4-diazepan-1-yl]thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-4-[4-(5-ethanoylpyridin-2-yl)-1,4-diazepan-1-yl]thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 4-[4-(5-acetyl-2-pyridyl)-1,4-diazepan-1-yl]-3-amino-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 4-[4-(5-acetyl-2-pyridinyl)-1,4-diazepan-1-yl]-3-amino-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 4-[4-(5-acetylpyridin-2-yl)-1,4-diazepan-1-yl]-3-aminothieno[2,3-b]pyridine-2-carboxamide Traditional Name: 4-[4-(5-acetyl-2-pyridyl)-1,4-diazepan-1-yl]-3-amino-thieno[2,3-b]pyridine-2-carboxamide Formula: C20H22N6O2S MolecularWeight: 410.49268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN=C(C=C1)N2CCCN(CC2)C3=C4C(=C(SC4=NC=C3)C(=O)N)N

Isomeric SMILES

CC(=O)C1=CN=C(C=C1)N2CCCN(CC2)C3=C4C(=C(SC4=NC=C3)C(=O)N)N

InChI

InChI=1S/C20H22N6O2S/c1-12(27)13-3-4-15(24-11-13)26-8-2-7-25(9-10-26)14-5-6-23-20-16(14)17(21)18(29-20)19(22)28/h3-6,11H,2,7-10,21H2,1H3,(H2,22,28)