(E)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(2-thienyl)acrylamide Formula: C18H22N3OS+ MolecularWeight: 328.45178

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C=CC3=CC=CS3

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C18H21N3OS/c1-20-10-12-21(13-11-20)17-7-3-2-6-16(17)19-18(22)9-8-15-5-4-14-23-15/h2-9,14H,10-13H2,1H3,(H,19,22)/p+1/b9-8+