4-oxidanyl-7-[1-[2-(3-phenethyloxypropylsulfonyl)ethylamino]ethyl]-3H-1,3-benzothiazol-2-one

Systemtic Name: 4-oxidanyl-7-[1-[2-(3-phenethyloxypropylsulfonyl)ethylamino]ethyl]-3H-1,3-benzothiazol-2-one Openeye Name: 4-hydroxy-7-[1-[2-(3-phenethyloxypropylsulfonyl)ethylamino]ethyl]-3H-1,3-benzothiazol-2-one CAS Name: 4-hydroxy-7-[1-[2-(3-phenethyloxypropylsulfonyl)ethylamino]ethyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 4-hydroxy-7-[1-[2-(3-phenethyloxypropylsulfonyl)ethylamino]ethyl]-3H-1,3-benzothiazol-2-one Traditional Name: 4-hydroxy-7-[1-[2-(3-phenethyloxypropylsulfonyl)ethylamino]ethyl]-3H-1,3-benzothiazol-2-one Formula: C22H28N2O5S2 MolecularWeight: 464.59812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C2C(=C(C=C1)O)NC(=O)S2)NCCS(=O)(=O)CCCOCCC3=CC=CC=C3

Isomeric SMILES

CC(C1=C2C(=C(C=C1)O)NC(=O)S2)NCCS(=O)(=O)CCCOCCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O5S2/c1-16(18-8-9-19(25)20-21(18)30-22(26)24-20)23-11-15-31(27,28)14-5-12-29-13-10-17-6-3-2-4-7-17/h2-4,6-9,16,23,25H,5,10-15H2,1H3,(H,24,26)