4-oxidanyl-7-[2-(6-phenoxyhexylamino)ethyl]-3H-1,3-benzothiazol-2-one

Systemtic Name: 4-oxidanyl-7-[2-(6-phenoxyhexylamino)ethyl]-3H-1,3-benzothiazol-2-one Openeye Name: 4-hydroxy-7-[2-(6-phenoxyhexylamino)ethyl]-3H-1,3-benzothiazol-2-one CAS Name: 4-hydroxy-7-[2-(6-phenoxyhexylamino)ethyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 4-hydroxy-7-[2-(6-phenoxyhexylamino)ethyl]-3H-1,3-benzothiazol-2-one Traditional Name: 4-hydroxy-7-[2-(6-phenoxyhexylamino)ethyl]-3H-1,3-benzothiazol-2-one Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCCCCNCCC2=C3C(=C(C=C2)O)NC(=O)S3

Isomeric SMILES

C1=CC=C(C=C1)OCCCCCCNCCC2=C3C(=C(C=C2)O)NC(=O)S3

InChI

InChI=1S/C21H26N2O3S/c24-18-11-10-16(20-19(18)23-21(25)27-20)12-14-22-13-6-1-2-7-15-26-17-8-4-3-5-9-17/h3-5,8-11,22,24H,1-2,6-7,12-15H2,(H,23,25)