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

Systemtic Name: ethyl 3-[3-(2-azanylidene-3-methyl-1,3-benzothiazol-6-yl)-4-(cyclopentylmethoxy)phenyl]propanoate Openeye Name: ethyl 3-[4-(cyclopentylmethoxy)-3-(2-imino-3-methyl-1,3-benzothiazol-6-yl)phenyl]propanoate CAS Name: 3-[4-(cyclopentylmethoxy)-3-(2-imino-3-methyl-1,3-benzothiazol-6-yl)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(cyclopentylmethoxy)-3-(2-imino-3-methyl-1,3-benzothiazol-6-yl)phenyl]propanoate Traditional Name: 3-[4-(cyclopentylmethoxy)-3-(2-imino-3-methyl-1,3-benzothiazol-6-yl)phenyl]propionic acid ethyl ester Formula: C25H30N2O3S MolecularWeight: 438.5823

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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(=N)S4)C

Isomeric SMILES

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

InChI

InChI=1S/C25H30N2O3S/c1-3-29-24(28)13-9-17-8-12-22(30-16-18-6-4-5-7-18)20(14-17)19-10-11-21-23(15-19)31-25(26)27(21)2/h8,10-12,14-15,18,26H,3-7,9,13,16H2,1-2H3