N-(1,3-benzothiazol-2-ylmethyl)-5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-aniline

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-aniline Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-isopropoxy-5-(1-piperidylsulfonyl)aniline CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-5-(1-piperidinylsulfonyl)-2-propan-2-yloxyaniline IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-5-piperidin-1-ylsulfonyl-2-propan-2-yloxyaniline Traditional Name: 1,3-benzothiazol-2-ylmethyl-(2-isopropoxy-5-piperidinosulfonyl-phenyl)amine Formula: C22H27N3O3S2 MolecularWeight: 445.59808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H27N3O3S2/c1-16(2)28-20-11-10-17(30(26,27)25-12-6-3-7-13-25)14-19(20)23-15-22-24-18-8-4-5-9-21(18)29-22/h4-5,8-11,14,16,23H,3,6-7,12-13,15H2,1-2H3