4-[3-[4-(1,3-benzothiazol-2-yloxy)phenyl]propyl-cyclopropyl-amino]butanoic acid

Systemtic Name: 4-[3-[4-(1,3-benzothiazol-2-yloxy)phenyl]propyl-cyclopropyl-amino]butanoic acid Openeye Name: 4-[3-[4-(1,3-benzothiazol-2-yloxy)phenyl]propyl-cyclopropyl-amino]butanoic acid CAS Name: 4-[3-[4-(1,3-benzothiazol-2-yloxy)phenyl]propyl-cyclopropylamino]butanoic acid IUPAC Name: 4-[3-[4-(1,3-benzothiazol-2-yloxy)phenyl]propyl-cyclopropylamino]butanoic acid Traditional Name: 4-[3-[4-(1,3-benzothiazol-2-yloxy)phenyl]propyl-cyclopropyl-amino]butyric acid Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CCCC2=CC=C(C=C2)OC3=NC4=CC=CC=C4S3)CCCC(=O)O

Isomeric SMILES

C1CC1N(CCCC2=CC=C(C=C2)OC3=NC4=CC=CC=C4S3)CCCC(=O)O

InChI

InChI=1S/C23H26N2O3S/c26-22(27)8-4-16-25(18-11-12-18)15-3-5-17-9-13-19(14-10-17)28-23-24-20-6-1-2-7-21(20)29-23/h1-2,6-7,9-10,13-14,18H,3-5,8,11-12,15-16H2,(H,26,27)