2-[(3S)-1-(azepan-1-ylsulfonyl)piperidin-3-yl]-1,3-benzothiazole

Systemtic Name: 2-[(3S)-1-(azepan-1-ylsulfonyl)piperidin-3-yl]-1,3-benzothiazole Openeye Name: 2-[(3S)-1-(azepan-1-ylsulfonyl)-3-piperidyl]-1,3-benzothiazole CAS Name: 2-[(3S)-1-(1-azepanylsulfonyl)-3-piperidinyl]-1,3-benzothiazole IUPAC Name: 2-[(3S)-1-(azepan-1-ylsulfonyl)piperidin-3-yl]-1,3-benzothiazole Traditional Name: 2-[(3S)-1-(azepan-1-ylsulfonyl)-3-piperidyl]-1,3-benzothiazole Formula: C18H25N3O2S2 MolecularWeight: 379.54

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCC[C@@H](C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H25N3O2S2/c22-25(23,20-11-5-1-2-6-12-20)21-13-7-8-15(14-21)18-19-16-9-3-4-10-17(16)24-18/h3-4,9-10,15H,1-2,5-8,11-14H2/t15-/m0/s1