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

Systemtic Name: 4-oxidanyl-7-[2-[4-(4-phenylbutoxy)butylamino]ethyl]-3H-1,3-benzothiazol-2-one Openeye Name: 4-hydroxy-7-[2-[4-(4-phenylbutoxy)butylamino]ethyl]-3H-1,3-benzothiazol-2-one CAS Name: 4-hydroxy-7-[2-[4-(4-phenylbutoxy)butylamino]ethyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 4-hydroxy-7-[2-[4-(4-phenylbutoxy)butylamino]ethyl]-3H-1,3-benzothiazol-2-one Traditional Name: 4-hydroxy-7-[2-[4-(4-phenylbutoxy)butylamino]ethyl]-3H-1,3-benzothiazol-2-one Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOCCCCNCCC2=C3C(=C(C=C2)O)NC(=O)S3

Isomeric SMILES

C1=CC=C(C=C1)CCCCOCCCCNCCC2=C3C(=C(C=C2)O)NC(=O)S3

InChI

InChI=1S/C23H30N2O3S/c26-20-12-11-19(22-21(20)25-23(27)29-22)13-15-24-14-5-7-17-28-16-6-4-10-18-8-2-1-3-9-18/h1-3,8-9,11-12,24,26H,4-7,10,13-17H2,(H,25,27)