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

Systemtic Name: 3-azanyl-4,6-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-4,6-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-4,6-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-4,6-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-4,6-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)thieno[2,3-b]pyridine-2-carboxamide Formula: C17H13N5O3S2 MolecularWeight: 399.44682

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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)[N+](=O)[O-])N)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])N)C

InChI

InChI=1S/C17H13N5O3S2/c1-7-5-8(2)19-16-12(7)13(18)14(27-16)15(23)21-17-20-10-4-3-9(22(24)25)6-11(10)26-17/h3-6H,18H2,1-2H3,(H,20,21,23)