ethyl 3-[4-(cyclopentylmethoxy)-3-(3-methyl-2-methylimino-1,3-benzothiazol-6-yl)phenyl]propanoate

Systemtic Name: ethyl 3-[4-(cyclopentylmethoxy)-3-(3-methyl-2-methylimino-1,3-benzothiazol-6-yl)phenyl]propanoate Openeye Name: ethyl 3-[4-(cyclopentylmethoxy)-3-(3-methyl-2-methylimino-1,3-benzothiazol-6-yl)phenyl]propanoate CAS Name: 3-[4-(cyclopentylmethoxy)-3-(3-methyl-2-methylimino-1,3-benzothiazol-6-yl)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(cyclopentylmethoxy)-3-(3-methyl-2-methylimino-1,3-benzothiazol-6-yl)phenyl]propanoate Traditional Name: 3-[4-(cyclopentylmethoxy)-3-(3-methyl-2-methylimino-1,3-benzothiazol-6-yl)phenyl]propionic acid ethyl ester Formula: C26H32N2O3S MolecularWeight: 452.60888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC(=C(C=C1)OCC2CCCC2)C3=CC4=C(C=C3)N(C(=NC)S4)C

Isomeric SMILES

CCOC(=O)CCC1=CC(=C(C=C1)OCC2CCCC2)C3=CC4=C(C=C3)N(C(=NC)S4)C

InChI

InChI=1S/C26H32N2O3S/c1-4-30-25(29)14-10-18-9-13-23(31-17-19-7-5-6-8-19)21(15-18)20-11-12-22-24(16-20)32-26(27-2)28(22)3/h9,11-13,15-16,19H,4-8,10,14,17H2,1-3H3