4-(1-ethyl-2-phenyl-indol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole

Systemtic Name: 4-(1-ethyl-2-phenyl-indol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole Openeye Name: 4-(1-ethyl-2-phenyl-indol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)thiazole CAS Name: 4-(1-ethyl-2-phenyl-3-indolyl)-2-(4-methyl-1-piperazin-4-iumyl)thiazole IUPAC Name: 4-(1-ethyl-2-phenylindol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole Traditional Name: 4-(1-ethyl-2-phenyl-indol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)thiazole Formula: C24H27N4S+ MolecularWeight: 403.56298

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C4=CSC(=N4)N5CC[NH+](CC5)C

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C4=CSC(=N4)N5CC[NH+](CC5)C

InChI

InChI=1S/C24H26N4S/c1-3-28-21-12-8-7-11-19(21)22(23(28)18-9-5-4-6-10-18)20-17-29-24(25-20)27-15-13-26(2)14-16-27/h4-12,17H,3,13-16H2,1-2H3/p+1