N-[3-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethyl-thiophen-2-yl]-4-methoxy-benzamide

Systemtic Name: N-[3-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethyl-thiophen-2-yl]-4-methoxy-benzamide Openeye Name: N-[3-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethyl-2-thienyl]-4-methoxy-benzamide CAS Name: N-[3-[[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]methyl]-4,5-dimethyl-2-thiophenyl]-4-methoxybenzamide IUPAC Name: N-[3-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethylthiophen-2-yl]-4-methoxybenzamide Traditional Name: N-[3-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethyl-2-thienyl]-4-methoxy-benzamide Formula: C21H30N3O3S+ MolecularWeight: 404.5462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C[NH+]2CCN(CC2)CCO)NC(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(SC(=C1C[NH+]2CCN(CC2)CCO)NC(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C21H29N3O3S/c1-15-16(2)28-21(22-20(26)17-4-6-18(27-3)7-5-17)19(15)14-24-10-8-23(9-11-24)12-13-25/h4-7,25H,8-14H2,1-3H3,(H,22,26)/p+1