ethyl 2-[(6-diazenyl-5-pentan-3-yloxy-1,3-benzothiazol-2-yl)-(2-ethoxy-2-oxidanylidene-ethyl)amino]ethanoate

Systemtic Name: ethyl 2-[(6-diazenyl-5-pentan-3-yloxy-1,3-benzothiazol-2-yl)-(2-ethoxy-2-oxidanylidene-ethyl)amino]ethanoate Openeye Name: ethyl 2-[[6-diazenyl-5-(1-ethylpropoxy)-1,3-benzothiazol-2-yl]-(2-ethoxy-2-oxo-ethyl)amino]acetate CAS Name: 2-[(6-diazenyl-5-pentan-3-yloxy-1,3-benzothiazol-2-yl)-(2-ethoxy-2-oxoethyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(6-diazenyl-5-pentan-3-yloxy-1,3-benzothiazol-2-yl)-(2-ethoxy-2-oxoethyl)amino]acetate Traditional Name: 2-[[6-diazenyl-5-(1-ethylpropoxy)-1,3-benzothiazol-2-yl]-(2-ethoxy-2-keto-ethyl)amino]acetic acid ethyl ester Formula: C20H28N4O5S MolecularWeight: 436.52512

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1=C(C=C2C(=C1)N=C(S2)N(CC(=O)OCC)CC(=O)OCC)N=N

Isomeric SMILES

CCC(CC)OC1=C(C=C2C(=C1)N=C(S2)N(CC(=O)OCC)CC(=O)OCC)N=N

InChI

InChI=1S/C20H28N4O5S/c1-5-13(6-2)29-16-9-15-17(10-14(16)23-21)30-20(22-15)24(11-18(25)27-7-3)12-19(26)28-8-4/h9-10,13,21H,5-8,11-12H2,1-4H3