butyl 3-[2-[(5R)-2-(diethylamino)-4-oxidanylidene-1,3-thiazol-5-yl]ethanoylamino]benzoate

Systemtic Name: butyl 3-[2-[(5R)-2-(diethylamino)-4-oxidanylidene-1,3-thiazol-5-yl]ethanoylamino]benzoate Openeye Name: butyl 3-[[2-[(5R)-2-(diethylamino)-4-oxo-thiazol-5-yl]acetyl]amino]benzoate CAS Name: 3-[[2-[(5R)-2-(diethylamino)-4-oxo-5-thiazolyl]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[[2-[(5R)-2-(diethylamino)-4-oxo-1,3-thiazol-5-yl]acetyl]amino]benzoate Traditional Name: 3-[[2-[(5R)-2-(diethylamino)-4-keto-2-thiazolin-5-yl]acetyl]amino]benzoic acid butyl ester Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)CC2C(=O)N=C(S2)N(CC)CC

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)C[C@@H]2C(=O)N=C(S2)N(CC)CC

InChI

InChI=1S/C20H27N3O4S/c1-4-7-11-27-19(26)14-9-8-10-15(12-14)21-17(24)13-16-18(25)22-20(28-16)23(5-2)6-3/h8-10,12,16H,4-7,11,13H2,1-3H3,(H,21,24)/t16-/m1/s1