1,3-benzothiazol-2-ylmethyl-methyl-[(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-methyl-[[5-(4-morpholinylsulfonyl)-1-propyl-2-benzimidazolyl]methyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(5-morpholin-4-ylsulfonyl-1-propylbenzimidazol-2-yl)methyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl]ammonium Formula: C24H30N5O3S2+ MolecularWeight: 500.6567

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C[NH+](C)CC4=NC5=CC=CC=C5S4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C[NH+](C)CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H29N5O3S2/c1-3-10-29-21-9-8-18(34(30,31)28-11-13-32-14-12-28)15-20(21)25-23(29)16-27(2)17-24-26-19-6-4-5-7-22(19)33-24/h4-9,15H,3,10-14,16-17H2,1-2H3/p+1