N-[2-(4-ethylpiperazin-4-ium-1-yl)-4-methyl-quinolin-6-yl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-4-methyl-quinolin-6-yl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-4-methyl-6-quinolyl]-3-(2-thienyl)prop-2-enamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)-4-methyl-6-quinolinyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-4-methylquinolin-6-yl]-3-thiophen-2-ylprop-2-enamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-4-methyl-6-quinolyl]-3-(2-thienyl)acrylamide Formula: C23H27N4OS+ MolecularWeight: 407.55168

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)C=CC4=CC=CS4)C(=C2)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)C=CC4=CC=CS4)C(=C2)C

InChI

InChI=1S/C23H26N4OS/c1-3-26-10-12-27(13-11-26)22-15-17(2)20-16-18(6-8-21(20)25-22)24-23(28)9-7-19-5-4-14-29-19/h4-9,14-16H,3,10-13H2,1-2H3,(H,24,28)/p+1