3,4-dimethyl-N-[2-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3,4-dimethyl-N-[2-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3,4-dimethyl-N-[2-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]amino]-2-oxo-ethyl]benzamide CAS Name: 3,4-dimethyl-N-[2-[[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]amino]-2-oxoethyl]benzamide IUPAC Name: 3,4-dimethyl-N-[2-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]amino]-2-oxoethyl]benzamide Traditional Name: N-[2-keto-2-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]amino]ethyl]-3,4-dimethyl-benzamide Formula: C21H28N5O2+ MolecularWeight: 382.47932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=CN=C(C=C2)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=CN=C(C=C2)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C21H27N5O2/c1-15-4-5-17(12-16(15)2)21(28)23-14-20(27)24-18-6-7-19(22-13-18)26-10-8-25(3)9-11-26/h4-7,12-13H,8-11,14H2,1-3H3,(H,23,28)(H,24,27)/p+1