N-[4-[[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylanilino]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Formula: C25H29N4O2S+ MolecularWeight: 449.58836

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4)C

InChI

InChI=1S/C25H28N4O2S/c1-3-28-12-14-29(15-13-28)21-10-11-22(18(2)17-21)27-24(30)19-6-8-20(9-7-19)26-25(31)23-5-4-16-32-23/h4-11,16-17H,3,12-15H2,1-2H3,(H,26,31)(H,27,30)/p+1