3-azanyl-6-(1,3-benzodioxol-5-yl)-N-(3-chloranyl-4-methyl-phenyl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-6-(1,3-benzodioxol-5-yl)-N-(3-chloranyl-4-methyl-phenyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-6-(1,3-benzodioxol-5-yl)-N-(3-chloro-4-methyl-phenyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-6-(1,3-benzodioxol-5-yl)-N-(3-chloro-4-methylphenyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-6-(1,3-benzodioxol-5-yl)-N-(3-chloro-4-methylphenyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-6-(1,3-benzodioxol-5-yl)-N-(3-chloro-4-methyl-phenyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C22H16ClN3O3S MolecularWeight: 437.89874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CC5=C(C=C4)OCO5)N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CC5=C(C=C4)OCO5)N)Cl

InChI

InChI=1S/C22H16ClN3O3S/c1-11-2-4-13(9-15(11)23)25-21(27)20-19(24)14-5-6-16(26-22(14)30-20)12-3-7-17-18(8-12)29-10-28-17/h2-9H,10,24H2,1H3,(H,25,27)