2-(4-methylpiperazin-4-ium-1-yl)-4-(1-methylsulfonyl-2,3-dihydroindol-5-yl)-1,3-thiazole

Systemtic Name: 2-(4-methylpiperazin-4-ium-1-yl)-4-(1-methylsulfonyl-2,3-dihydroindol-5-yl)-1,3-thiazole Openeye Name: 2-(4-methylpiperazin-4-ium-1-yl)-4-(1-methylsulfonylindolin-5-yl)thiazole CAS Name: 2-(4-methyl-1-piperazin-4-iumyl)-4-(1-methylsulfonyl-2,3-dihydroindol-5-yl)thiazole IUPAC Name: 2-(4-methylpiperazin-4-ium-1-yl)-4-(1-methylsulfonyl-2,3-dihydroindol-5-yl)-1,3-thiazole Traditional Name: 4-(1-mesylindolin-5-yl)-2-(4-methylpiperazin-4-ium-1-yl)thiazole Formula: C17H23N4O2S2+ MolecularWeight: 379.52012

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC(=CS2)C3=CC4=C(C=C3)N(CC4)S(=O)(=O)C

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC(=CS2)C3=CC4=C(C=C3)N(CC4)S(=O)(=O)C

InChI

InChI=1S/C17H22N4O2S2/c1-19-7-9-20(10-8-19)17-18-15(12-24-17)13-3-4-16-14(11-13)5-6-21(16)25(2,22)23/h3-4,11-12H,5-10H2,1-2H3/p+1