butyl-ethyl-[[1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl]azanium

Systemtic Name: butyl-ethyl-[[1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl]azanium Openeye Name: butyl-ethyl-[[1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl]ammonium CAS Name: butyl-ethyl-[[1-(6-methyl-1,3-benzothiazol-2-yl)-2-pyrrolyl]methyl]ammonium IUPAC Name: butyl-ethyl-[[1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl]azanium Traditional Name: butyl-ethyl-[[1-(6-methyl-1,3-benzothiazol-2-yl)pyrrol-2-yl]methyl]ammonium Formula: C19H26N3S+ MolecularWeight: 328.49484

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)CC1=CC=CN1C2=NC3=C(S2)C=C(C=C3)C

Isomeric SMILES

CCCC[NH+](CC)CC1=CC=CN1C2=NC3=C(S2)C=C(C=C3)C

InChI

InChI=1S/C19H25N3S/c1-4-6-11-21(5-2)14-16-8-7-12-22(16)19-20-17-10-9-15(3)13-18(17)23-19/h7-10,12-13H,4-6,11,14H2,1-3H3/p+1