3-[[(2-oxidanylidene-1,3-benzothiazol-3-yl)methyl-(3-propan-2-yloxypropyl)amino]methyl]-1,3-benzothiazol-2-one

Systemtic Name: 3-[[(2-oxidanylidene-1,3-benzothiazol-3-yl)methyl-(3-propan-2-yloxypropyl)amino]methyl]-1,3-benzothiazol-2-one Openeye Name: 3-[[3-isopropoxypropyl-[(2-oxo-1,3-benzothiazol-3-yl)methyl]amino]methyl]-1,3-benzothiazol-2-one CAS Name: 3-[[(2-oxo-1,3-benzothiazol-3-yl)methyl-(3-propan-2-yloxypropyl)amino]methyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[[(2-oxo-1,3-benzothiazol-3-yl)methyl-(3-propan-2-yloxypropyl)amino]methyl]-1,3-benzothiazol-2-one Traditional Name: 3-[[3-isopropoxypropyl-[(2-keto-1,3-benzothiazol-3-yl)methyl]amino]methyl]-1,3-benzothiazol-2-one Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN(CN1C2=CC=CC=C2SC1=O)CN3C4=CC=CC=C4SC3=O

Isomeric SMILES

CC(C)OCCCN(CN1C2=CC=CC=C2SC1=O)CN3C4=CC=CC=C4SC3=O

InChI

InChI=1S/C22H25N3O3S2/c1-16(2)28-13-7-12-23(14-24-17-8-3-5-10-19(17)29-21(24)26)15-25-18-9-4-6-11-20(18)30-22(25)27/h3-6,8-11,16H,7,12-15H2,1-2H3