4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole

Systemtic Name: 4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole Openeye Name: 4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)thiazole CAS Name: 4-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-(4-methyl-1-piperazin-4-iumyl)thiazole IUPAC Name: 4-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole Traditional Name: 4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)thiazole Formula: C17H25N4S+ MolecularWeight: 317.4722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)N3CC[NH+](CC3)C

InChI

InChI=1S/C17H24N4S/c1-5-6-21-13(2)11-15(14(21)3)16-12-22-17(18-16)20-9-7-19(4)8-10-20/h5,11-12H,1,6-10H2,2-4H3/p+1