N-[[1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamine

Systemtic Name: N-[[1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamine Openeye Name: N-[[1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamine CAS Name: N-[[1-(6-methyl-1,3-benzothiazol-2-yl)-2-pyrrolyl]methyl]-2-(1-pyrrolidin-1-iumyl)ethanamine IUPAC Name: N-[[1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl]-2-pyrrolidin-1-ium-1-ylethanamine Traditional Name: [1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl-(2-pyrrolidin-1-ium-1-ylethyl)amine Formula: C19H25N4S+ MolecularWeight: 341.4936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N3C=CC=C3CNCC[NH+]4CCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N3C=CC=C3CNCC[NH+]4CCCC4

InChI

InChI=1S/C19H24N4S/c1-15-6-7-17-18(13-15)24-19(21-17)23-11-4-5-16(23)14-20-8-12-22-9-2-3-10-22/h4-7,11,13,20H,2-3,8-10,12,14H2,1H3/p+1