3-azanyl-4,6-dimethyl-N-phenethyl-thieno[2,3-b]pyridin-7-ium-2-carboxamide

Systemtic Name: 3-azanyl-4,6-dimethyl-N-phenethyl-thieno[2,3-b]pyridin-7-ium-2-carboxamide Openeye Name: 3-amino-4,6-dimethyl-N-phenethyl-thieno[2,3-b]pyridin-7-ium-2-carboxamide CAS Name: 3-amino-4,6-dimethyl-N-phenethyl-2-thieno[2,3-b]pyridin-7-iumcarboxamide IUPAC Name: 3-amino-4,6-dimethyl-N-phenethylthieno[2,3-b]pyridin-7-ium-2-carboxamide Traditional Name: 3-amino-4,6-dimethyl-N-phenethyl-thieno[2,3-b]pyridin-7-ium-2-carboxamide Formula: C18H20N3OS+ MolecularWeight: 326.4359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=C1C(=C(S2)C(=O)NCCC3=CC=CC=C3)N)C

Isomeric SMILES

CC1=CC(=[NH+]C2=C1C(=C(S2)C(=O)NCCC3=CC=CC=C3)N)C

InChI

InChI=1S/C18H19N3OS/c1-11-10-12(2)21-18-14(11)15(19)16(23-18)17(22)20-9-8-13-6-4-3-5-7-13/h3-7,10H,8-9,19H2,1-2H3,(H,20,22)/p+1