[2-(5-methylhexan-2-ylamino)-2-oxidanylidene-ethyl] 4-(1,3-thiazol-4-ylmethoxy)benzoate

Systemtic Name: [2-(5-methylhexan-2-ylamino)-2-oxidanylidene-ethyl] 4-(1,3-thiazol-4-ylmethoxy)benzoate Openeye Name: [2-(1,4-dimethylpentylamino)-2-oxo-ethyl] 4-(thiazol-4-ylmethoxy)benzoate CAS Name: 4-(4-thiazolylmethoxy)benzoic acid [2-(5-methylhexan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(5-methylhexan-2-ylamino)-2-oxoethyl] 4-(1,3-thiazol-4-ylmethoxy)benzoate Traditional Name: 4-(thiazol-4-ylmethoxy)benzoic acid [2-(1,4-dimethylpentylamino)-2-keto-ethyl] ester Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)COC(=O)C1=CC=C(C=C1)OCC2=CSC=N2

Isomeric SMILES

CC(C)CCC(C)NC(=O)COC(=O)C1=CC=C(C=C1)OCC2=CSC=N2

InChI

InChI=1S/C20H26N2O4S/c1-14(2)4-5-15(3)22-19(23)11-26-20(24)16-6-8-18(9-7-16)25-10-17-12-27-13-21-17/h6-9,12-15H,4-5,10-11H2,1-3H3,(H,22,23)