methyl 2-[3-(2-azanyl-1,3-benzothiazol-5-yl)-4-(cyclopentylmethoxy)phenyl]propanoate

Systemtic Name: methyl 2-[3-(2-azanyl-1,3-benzothiazol-5-yl)-4-(cyclopentylmethoxy)phenyl]propanoate Openeye Name: methyl 2-[3-(2-amino-1,3-benzothiazol-5-yl)-4-(cyclopentylmethoxy)phenyl]propanoate CAS Name: 2-[3-(2-amino-1,3-benzothiazol-5-yl)-4-(cyclopentylmethoxy)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-[3-(2-amino-1,3-benzothiazol-5-yl)-4-(cyclopentylmethoxy)phenyl]propanoate Traditional Name: 2-[3-(2-amino-1,3-benzothiazol-5-yl)-4-(cyclopentylmethoxy)phenyl]propionic acid methyl ester Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OCC2CCCC2)C3=CC4=C(C=C3)SC(=N4)N)C(=O)OC

Isomeric SMILES

CC(C1=CC(=C(C=C1)OCC2CCCC2)C3=CC4=C(C=C3)SC(=N4)N)C(=O)OC

InChI

InChI=1S/C23H26N2O3S/c1-14(22(26)27-2)16-7-9-20(28-13-15-5-3-4-6-15)18(11-16)17-8-10-21-19(12-17)25-23(24)29-21/h7-12,14-15H,3-6,13H2,1-2H3,(H2,24,25)