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

Systemtic Name: 4-oxidanyl-7-[2-[3-(3-phenethyloxypropylsulfanyl)propylamino]ethyl]-3H-1,3-benzothiazol-2-one Openeye Name: 4-hydroxy-7-[2-[3-(3-phenethyloxypropylsulfanyl)propylamino]ethyl]-3H-1,3-benzothiazol-2-one CAS Name: 4-hydroxy-7-[2-[3-(3-phenethyloxypropylthio)propylamino]ethyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 4-hydroxy-7-[2-[3-(3-phenethyloxypropylsulfanyl)propylamino]ethyl]-3H-1,3-benzothiazol-2-one Traditional Name: 4-hydroxy-7-[2-[3-(3-phenethyloxypropylthio)propylamino]ethyl]-3H-1,3-benzothiazol-2-one Formula: C23H30N2O3S2 MolecularWeight: 446.6259

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOCCCSCCCNCCC2=C3C(=C(C=C2)O)NC(=O)S3

Isomeric SMILES

C1=CC=C(C=C1)CCOCCCSCCCNCCC2=C3C(=C(C=C2)O)NC(=O)S3

InChI

InChI=1S/C23H30N2O3S2/c26-20-9-8-19(22-21(20)25-23(27)30-22)10-13-24-12-4-16-29-17-5-14-28-15-11-18-6-2-1-3-7-18/h1-3,6-9,24,26H,4-5,10-17H2,(H,25,27)