1-[4-[[3-(4-chlorophenyl)-1,2-benzothiazol-6-yl]oxy]butyl]pyrrolidin-3-ol

Systemtic Name: 1-[4-[[3-(4-chlorophenyl)-1,2-benzothiazol-6-yl]oxy]butyl]pyrrolidin-3-ol Openeye Name: 1-[4-[[3-(4-chlorophenyl)-1,2-benzothiazol-6-yl]oxy]butyl]pyrrolidin-3-ol CAS Name: 1-[4-[[3-(4-chlorophenyl)-1,2-benzothiazol-6-yl]oxy]butyl]-3-pyrrolidinol IUPAC Name: 1-[4-[[3-(4-chlorophenyl)-1,2-benzothiazol-6-yl]oxy]butyl]pyrrolidin-3-ol Traditional Name: 1-[4-[[3-(4-chlorophenyl)-1,2-benzothiazol-6-yl]oxy]butyl]pyrrolidin-3-ol Formula: C21H23ClN2O2S MolecularWeight: 402.93752

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1O)CCCCOC2=CC3=C(C=C2)C(=NS3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CC1O)CCCCOC2=CC3=C(C=C2)C(=NS3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN2O2S/c22-16-5-3-15(4-6-16)21-19-8-7-18(13-20(19)27-23-21)26-12-2-1-10-24-11-9-17(25)14-24/h3-8,13,17,25H,1-2,9-12,14H2