N-[2-[[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-anilino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[2-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylanilino]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylanilino]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-anilino]-2-keto-ethyl]thiophene-2-carboxamide Formula: C20H27N4O2S+ MolecularWeight: 387.51898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O2S/c1-3-23-8-10-24(11-9-23)17-7-6-16(13-15(17)2)22-19(25)14-21-20(26)18-5-4-12-27-18/h4-7,12-13H,3,8-11,14H2,1-2H3,(H,21,26)(H,22,25)/p+1