2-(4-ethylpiperazin-1-ium-1-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,3-dihydroindene-2-carboxamide

Systemtic Name: 2-(4-ethylpiperazin-1-ium-1-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,3-dihydroindene-2-carboxamide Openeye Name: 2-(4-ethylpiperazin-1-ium-1-yl)-N-[(4-methylthiazol-2-yl)methyl]indane-2-carboxamide CAS Name: 2-(4-ethyl-1-piperazin-1-iumyl)-N-[(4-methyl-2-thiazolyl)methyl]-1,3-dihydroindene-2-carboxamide IUPAC Name: 2-(4-ethylpiperazin-1-ium-1-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,3-dihydroindene-2-carboxamide Traditional Name: 2-(4-ethylpiperazin-1-ium-1-yl)-N-[(4-methylthiazol-2-yl)methyl]indane-2-carboxamide Formula: C21H29N4OS+ MolecularWeight: 385.54616

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)NCC4=NC(=CS4)C

Isomeric SMILES

CCN1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)NCC4=NC(=CS4)C

InChI

InChI=1S/C21H28N4OS/c1-3-24-8-10-25(11-9-24)21(12-17-6-4-5-7-18(17)13-21)20(26)22-14-19-23-16(2)15-27-19/h4-7,15H,3,8-14H2,1-2H3,(H,22,26)/p+1