7-[2-[(2-methyl-7-phenethyloxy-heptan-2-yl)amino]ethyl]-4-oxidanyl-3H-1,3-benzothiazol-2-one

Systemtic Name: 7-[2-[(2-methyl-7-phenethyloxy-heptan-2-yl)amino]ethyl]-4-oxidanyl-3H-1,3-benzothiazol-2-one Openeye Name: 7-[2-[(1,1-dimethyl-6-phenethyloxy-hexyl)amino]ethyl]-4-hydroxy-3H-1,3-benzothiazol-2-one CAS Name: 4-hydroxy-7-[2-[(2-methyl-7-phenethyloxyheptan-2-yl)amino]ethyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 4-hydroxy-7-[2-[(2-methyl-7-phenethyloxyheptan-2-yl)amino]ethyl]-3H-1,3-benzothiazol-2-one Traditional Name: 7-[2-[(1,1-dimethyl-6-phenethyloxy-hexyl)amino]ethyl]-4-hydroxy-3H-1,3-benzothiazol-2-one Formula: C25H34N2O3S MolecularWeight: 442.61406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCCOCCC1=CC=CC=C1)NCCC2=C3C(=C(C=C2)O)NC(=O)S3

Isomeric SMILES

CC(C)(CCCCCOCCC1=CC=CC=C1)NCCC2=C3C(=C(C=C2)O)NC(=O)S3

InChI

InChI=1S/C25H34N2O3S/c1-25(2,15-7-4-8-17-30-18-14-19-9-5-3-6-10-19)26-16-13-20-11-12-21(28)22-23(20)31-24(29)27-22/h3,5-6,9-12,26,28H,4,7-8,13-18H2,1-2H3,(H,27,29)