N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-quinolin-1-ium-3-yl]methyl]thiophene-2-carboxamide

Systemtic Name: N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-quinolin-1-ium-3-yl]methyl]thiophene-2-carboxamide Openeye Name: N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-quinolin-1-ium-3-yl]methyl]thiophene-2-carboxamide CAS Name: N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-3-quinolin-1-iumyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-cyclopropyl-N-[[2-(dimethylamino)-7-methylquinolin-1-ium-3-yl]methyl]thiophene-2-carboxamide Traditional Name: N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-quinolin-1-ium-3-yl]methyl]thiophene-2-carboxamide Formula: C21H24N3OS+ MolecularWeight: 366.49976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[NH+]C(=C(C=C2C=C1)CN(C3CC3)C(=O)C4=CC=CS4)N(C)C

Isomeric SMILES

CC1=CC2=[NH+]C(=C(C=C2C=C1)CN(C3CC3)C(=O)C4=CC=CS4)N(C)C

InChI

InChI=1S/C21H23N3OS/c1-14-6-7-15-12-16(20(23(2)3)22-18(15)11-14)13-24(17-8-9-17)21(25)19-5-4-10-26-19/h4-7,10-12,17H,8-9,13H2,1-3H3/p+1