6-methyl-2-[2-[(4-methylpiperazin-4-ium-1-yl)methyl]pyrrol-1-yl]-1,3-benzothiazole

Systemtic Name: 6-methyl-2-[2-[(4-methylpiperazin-4-ium-1-yl)methyl]pyrrol-1-yl]-1,3-benzothiazole Openeye Name: 6-methyl-2-[2-[(4-methylpiperazin-4-ium-1-yl)methyl]pyrrol-1-yl]-1,3-benzothiazole CAS Name: 6-methyl-2-[2-[(4-methyl-1-piperazin-4-iumyl)methyl]-1-pyrrolyl]-1,3-benzothiazole IUPAC Name: 6-methyl-2-[2-[(4-methylpiperazin-4-ium-1-yl)methyl]pyrrol-1-yl]-1,3-benzothiazole Traditional Name: 6-methyl-2-[2-[(4-methylpiperazin-4-ium-1-yl)methyl]pyrrol-1-yl]-1,3-benzothiazole Formula: C18H23N4S+ MolecularWeight: 327.46702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N3C=CC=C3CN4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N3C=CC=C3CN4CC[NH+](CC4)C

InChI

InChI=1S/C18H22N4S/c1-14-5-6-16-17(12-14)23-18(19-16)22-7-3-4-15(22)13-21-10-8-20(2)9-11-21/h3-7,12H,8-11,13H2,1-2H3/p+1