[(2R)-1-[cyclohexyl(1,3-thiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl] 4-aminocarbonylbenzoate

Systemtic Name: [(2R)-1-[cyclohexyl(1,3-thiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl] 4-aminocarbonylbenzoate Openeye Name: [(1R)-2-[cyclohexyl(thiazol-2-yl)amino]-1-methyl-2-oxo-ethyl] 4-carbamoylbenzoate CAS Name: 4-carbamoylbenzoic acid [(2R)-1-[cyclohexyl(2-thiazolyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[cyclohexyl(1,3-thiazol-2-yl)amino]-1-oxopropan-2-yl] 4-carbamoylbenzoate Traditional Name: 4-carbamoylbenzoic acid [(1R)-2-[cyclohexyl(thiazol-2-yl)amino]-2-keto-1-methyl-ethyl] ester Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C1CCCCC1)C2=NC=CS2)OC(=O)C3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C[C@H](C(=O)N(C1CCCCC1)C2=NC=CS2)OC(=O)C3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C20H23N3O4S/c1-13(27-19(26)15-9-7-14(8-10-15)17(21)24)18(25)23(20-22-11-12-28-20)16-5-3-2-4-6-16/h7-13,16H,2-6H2,1H3,(H2,21,24)/t13-/m1/s1