2-[[4-(azepan-1-ylsulfonyl)piperazin-1-yl]methyl]-1,3-benzothiazole

Systemtic Name: 2-[[4-(azepan-1-ylsulfonyl)piperazin-1-yl]methyl]-1,3-benzothiazole Openeye Name: 2-[[4-(azepan-1-ylsulfonyl)piperazin-1-yl]methyl]-1,3-benzothiazole CAS Name: 2-[[4-(1-azepanylsulfonyl)-1-piperazinyl]methyl]-1,3-benzothiazole IUPAC Name: 2-[[4-(azepan-1-ylsulfonyl)piperazin-1-yl]methyl]-1,3-benzothiazole Traditional Name: 2-[[4-(azepan-1-ylsulfonyl)piperazino]methyl]-1,3-benzothiazole Formula: C18H26N4O2S2 MolecularWeight: 394.55464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H26N4O2S2/c23-26(24,21-9-5-1-2-6-10-21)22-13-11-20(12-14-22)15-18-19-16-7-3-4-8-17(16)25-18/h3-4,7-8H,1-2,5-6,9-15H2