3-azanyl-4,6-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-4,6-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-4,6-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-4,6-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-4,6-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-N-(6-mesyl-1,3-benzothiazol-2-yl)-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C18H16N4O3S3 MolecularWeight: 432.53964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)N)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)N)C

InChI

InChI=1S/C18H16N4O3S3/c1-8-6-9(2)20-17-13(8)14(19)15(27-17)16(23)22-18-21-11-5-4-10(28(3,24)25)7-12(11)26-18/h4-7H,19H2,1-3H3,(H,21,22,23)