3-azanyl-N-(2-butylsulfanylphenyl)-6-thiophen-2-yl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-N-(2-butylsulfanylphenyl)-6-thiophen-2-yl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-N-(2-butylsulfanylphenyl)-6-(2-thienyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-N-[2-(butylthio)phenyl]-6-thiophen-2-yl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-N-(2-butylsulfanylphenyl)-6-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-N-[2-(butylthio)phenyl]-6-(2-thienyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C22H21N3OS3 MolecularWeight: 439.61664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=CC=C1NC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CC=CS4)N

Isomeric SMILES

CCCCSC1=CC=CC=C1NC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CC=CS4)N

InChI

InChI=1S/C22H21N3OS3/c1-2-3-12-27-17-8-5-4-7-15(17)24-21(26)20-19(23)14-10-11-16(25-22(14)29-20)18-9-6-13-28-18/h4-11,13H,2-3,12,23H2,1H3,(H,24,26)