3-azanyl-4,6-dimethyl-N-[4-(4-nitrophenyl)sulfanylphenyl]thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-4,6-dimethyl-N-[4-(4-nitrophenyl)sulfanylphenyl]thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-4,6-dimethyl-N-[4-(4-nitrophenyl)sulfanylphenyl]thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-4,6-dimethyl-N-[4-[(4-nitrophenyl)thio]phenyl]-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-4,6-dimethyl-N-[4-(4-nitrophenyl)sulfanylphenyl]thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-4,6-dimethyl-N-[4-[(4-nitrophenyl)thio]phenyl]thieno[2,3-b]pyridine-2-carboxamide Formula: C22H18N4O3S2 MolecularWeight: 450.53332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)NC3=CC=C(C=C3)SC4=CC=C(C=C4)[N+](=O)[O-])N)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)NC3=CC=C(C=C3)SC4=CC=C(C=C4)[N+](=O)[O-])N)C

InChI

InChI=1S/C22H18N4O3S2/c1-12-11-13(2)24-22-18(12)19(23)20(31-22)21(27)25-14-3-7-16(8-4-14)30-17-9-5-15(6-10-17)26(28)29/h3-11H,23H2,1-2H3,(H,25,27)