N-[3-[(2-methoxyphenyl)-(4-methylpiperazine-1,4-diium-1-yl)methyl]-4,5-dimethyl-thiophen-2-yl]benzamide

Systemtic Name: N-[3-[(2-methoxyphenyl)-(4-methylpiperazine-1,4-diium-1-yl)methyl]-4,5-dimethyl-thiophen-2-yl]benzamide Openeye Name: N-[3-[(2-methoxyphenyl)-(4-methylpiperazine-1,4-diium-1-yl)methyl]-4,5-dimethyl-2-thienyl]benzamide CAS Name: N-[3-[(2-methoxyphenyl)-(4-methyl-1-piperazine-1,4-diiumyl)methyl]-4,5-dimethyl-2-thiophenyl]benzamide IUPAC Name: N-[3-[(2-methoxyphenyl)-(4-methylpiperazine-1,4-diium-1-yl)methyl]-4,5-dimethylthiophen-2-yl]benzamide Traditional Name: N-[3-[(2-methoxyphenyl)-(4-methylpiperazine-1,4-diium-1-yl)methyl]-4,5-dimethyl-2-thienyl]benzamide Formula: C26H33N3O2S+2 MolecularWeight: 451.62412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(C2=CC=CC=C2OC)[NH+]3CC[NH+](CC3)C)NC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C(C2=CC=CC=C2OC)[NH+]3CC[NH+](CC3)C)NC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C26H31N3O2S/c1-18-19(2)32-26(27-25(30)20-10-6-5-7-11-20)23(18)24(29-16-14-28(3)15-17-29)21-12-8-9-13-22(21)31-4/h5-13,24H,14-17H2,1-4H3,(H,27,30)/p+2