ethyl 3-[3-(2-azanyl-1,3-benzothiazol-6-yl)-4-cyclohexyloxy-phenyl]propanoate

Systemtic Name: ethyl 3-[3-(2-azanyl-1,3-benzothiazol-6-yl)-4-cyclohexyloxy-phenyl]propanoate Openeye Name: ethyl 3-[3-(2-amino-1,3-benzothiazol-6-yl)-4-(cyclohexoxy)phenyl]propanoate CAS Name: 3-[3-(2-amino-1,3-benzothiazol-6-yl)-4-cyclohexyloxyphenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-(2-amino-1,3-benzothiazol-6-yl)-4-cyclohexyloxyphenyl]propanoate Traditional Name: 3-[3-(2-amino-1,3-benzothiazol-6-yl)-4-(cyclohexoxy)phenyl]propionic acid ethyl ester Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC(=C(C=C1)OC2CCCCC2)C3=CC4=C(C=C3)N=C(S4)N

Isomeric SMILES

CCOC(=O)CCC1=CC(=C(C=C1)OC2CCCCC2)C3=CC4=C(C=C3)N=C(S4)N

InChI

InChI=1S/C24H28N2O3S/c1-2-28-23(27)13-9-16-8-12-21(29-18-6-4-3-5-7-18)19(14-16)17-10-11-20-22(15-17)30-24(25)26-20/h8,10-12,14-15,18H,2-7,9,13H2,1H3,(H2,25,26)