3-[[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-4-methyl-1,3-thiazol-2-one

Systemtic Name: 3-[[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-4-methyl-1,3-thiazol-2-one Openeye Name: 3-[[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-4-methyl-thiazol-2-one CAS Name: 3-[[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazine-1,4-diiumyl]methyl]-4-methyl-2-thiazolone IUPAC Name: 3-[[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-4-methyl-1,3-thiazol-2-one Traditional Name: 3-[[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-4-methyl-4-thiazolin-2-one Formula: C17H22N4OS2+2 MolecularWeight: 362.51278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=O)N1C[NH+]2CC[NH+](CC2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CSC(=O)N1C[NH+]2CC[NH+](CC2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H20N4OS2/c1-13-11-23-17(22)21(13)12-20-8-6-19(7-9-20)10-16-18-14-4-2-3-5-15(14)24-16/h2-5,11H,6-10,12H2,1H3/p+2