4-(3-azanyl-6-propyl-thieno[2,3-b]pyridin-2-yl)carbonyl-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-(3-azanyl-6-propyl-thieno[2,3-b]pyridin-2-yl)carbonyl-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-(3-amino-6-propyl-thieno[2,3-b]pyridine-2-carbonyl)-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[(3-amino-6-propyl-2-thieno[2,3-b]pyridinyl)-oxomethyl]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-(3-amino-6-propylthieno[2,3-b]pyridine-2-carbonyl)-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-(3-amino-6-propyl-thieno[2,3-b]pyridine-2-carbonyl)-N-(2-pyrimidyl)benzenesulfonamide Formula: C21H19N5O3S2 MolecularWeight: 453.53726

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C1)C(=C(S2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)N

Isomeric SMILES

CCCC1=NC2=C(C=C1)C(=C(S2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)N

InChI

InChI=1S/C21H19N5O3S2/c1-2-4-14-7-10-16-17(22)19(30-20(16)25-14)18(27)13-5-8-15(9-6-13)31(28,29)26-21-23-11-3-12-24-21/h3,5-12H,2,4,22H2,1H3,(H,23,24,26)