[(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-propan-2-yl] 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanoate

Systemtic Name: [(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-propan-2-yl] 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanoate Openeye Name: [(1R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-methyl-2-oxo-ethyl] 2-[2-(3-thienyl)thiazol-4-yl]acetate CAS Name: 2-[2-(3-thiophenyl)-4-thiazolyl]acetic acid [(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl] 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetate Traditional Name: 2-[2-(3-thienyl)thiazol-4-yl]acetic acid [(1R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-1-methyl-ethyl] ester Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C2C1)OC(=O)CC3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

C[C@H](C(=O)N1CCC2=CC=CC=C2C1)OC(=O)CC3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C21H20N2O3S2/c1-14(21(25)23-8-6-15-4-2-3-5-16(15)11-23)26-19(24)10-18-13-28-20(22-18)17-7-9-27-12-17/h2-5,7,9,12-14H,6,8,10-11H2,1H3/t14-/m1/s1