1-(3-azanyl-4,6-diphenyl-thieno[2,3-b]pyridin-7-ium-2-yl)ethanone

Systemtic Name: 1-(3-azanyl-4,6-diphenyl-thieno[2,3-b]pyridin-7-ium-2-yl)ethanone Openeye Name: 1-(3-amino-4,6-diphenyl-thieno[2,3-b]pyridin-7-ium-2-yl)ethanone CAS Name: 1-(3-amino-4,6-diphenyl-2-thieno[2,3-b]pyridin-7-iumyl)ethanone IUPAC Name: 1-(3-amino-4,6-diphenylthieno[2,3-b]pyridin-7-ium-2-yl)ethanone Traditional Name: 1-(3-amino-4,6-diphenyl-thieno[2,3-b]pyridin-7-ium-2-yl)ethanone Formula: C21H17N2OS+ MolecularWeight: 345.43748

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=C(S1)[NH+]=C(C=C2C3=CC=CC=C3)C4=CC=CC=C4)N

Isomeric SMILES

CC(=O)C1=C(C2=C(S1)[NH+]=C(C=C2C3=CC=CC=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C21H16N2OS/c1-13(24)20-19(22)18-16(14-8-4-2-5-9-14)12-17(23-21(18)25-20)15-10-6-3-7-11-15/h2-12H,22H2,1H3/p+1