3-azanyl-4-[4-[4-(dimethylamino)-4-oxidanylidene-butyl]phenoxy]thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-4-[4-[4-(dimethylamino)-4-oxidanylidene-butyl]phenoxy]thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-4-[4-[4-(dimethylamino)-4-oxo-butyl]phenoxy]thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-4-[4-[4-(dimethylamino)-4-oxobutyl]phenoxy]-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-4-[4-[4-(dimethylamino)-4-oxobutyl]phenoxy]thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-4-[4-[4-(dimethylamino)-4-keto-butyl]phenoxy]thieno[2,3-b]pyridine-2-carboxamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CCCC1=CC=C(C=C1)OC2=C3C(=C(SC3=NC=C2)C(=O)N)N

Isomeric SMILES

CN(C)C(=O)CCCC1=CC=C(C=C1)OC2=C3C(=C(SC3=NC=C2)C(=O)N)N

InChI

InChI=1S/C20H22N4O3S/c1-24(2)15(25)5-3-4-12-6-8-13(9-7-12)27-14-10-11-23-20-16(14)17(21)18(28-20)19(22)26/h6-11H,3-5,21H2,1-2H3,(H2,22,26)