3-azanyl-N-[(3,4-dichlorophenyl)methyl]-6-thiophen-2-yl-thieno[2,3-b]pyridin-7-ium-2-carboxamide

Systemtic Name: 3-azanyl-N-[(3,4-dichlorophenyl)methyl]-6-thiophen-2-yl-thieno[2,3-b]pyridin-7-ium-2-carboxamide Openeye Name: 3-amino-N-[(3,4-dichlorophenyl)methyl]-6-(2-thienyl)thieno[2,3-b]pyridin-7-ium-2-carboxamide CAS Name: 3-amino-N-[(3,4-dichlorophenyl)methyl]-6-thiophen-2-yl-2-thieno[2,3-b]pyridin-7-iumcarboxamide IUPAC Name: 3-amino-N-[(3,4-dichlorophenyl)methyl]-6-thiophen-2-ylthieno[2,3-b]pyridin-7-ium-2-carboxamide Traditional Name: 3-amino-N-(3,4-dichlorobenzyl)-6-(2-thienyl)thieno[2,3-b]pyridin-7-ium-2-carboxamide Formula: C19H14Cl2N3OS2+ MolecularWeight: 435.36996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=[NH+]C3=C(C=C2)C(=C(S3)C(=O)NCC4=CC(=C(C=C4)Cl)Cl)N

Isomeric SMILES

C1=CSC(=C1)C2=[NH+]C3=C(C=C2)C(=C(S3)C(=O)NCC4=CC(=C(C=C4)Cl)Cl)N

InChI

InChI=1S/C19H13Cl2N3OS2/c20-12-5-3-10(8-13(12)21)9-23-18(25)17-16(22)11-4-6-14(24-19(11)27-17)15-2-1-7-26-15/h1-8H,9,22H2,(H,23,25)/p+1