tert-butyl N-[2-[3-[(3R)-3,4-dihydro-2H-chromen-3-yl]-2-sulfanylidene-1H-imidazol-4-yl]ethyl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[2-[3-[(3R)-3,4-dihydro-2H-chromen-3-yl]-2-sulfanylidene-1H-imidazol-4-yl]ethyl]-N-methyl-carbamate Openeye Name: tert-butyl N-[2-[3-[(3R)-chroman-3-yl]-2-thioxo-1H-imidazol-4-yl]ethyl]-N-methyl-carbamate CAS Name: N-[2-[3-[(3R)-3,4-dihydro-2H-1-benzopyran-3-yl]-2-sulfanylidene-1H-imidazol-4-yl]ethyl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[3-[(3R)-3,4-dihydro-2H-chromen-3-yl]-2-sulfanylidene-1H-imidazol-4-yl]ethyl]-N-methylcarbamate Traditional Name: N-[2-[3-[(3R)-chroman-3-yl]-2-thioxo-4-imidazolin-4-yl]ethyl]-N-methyl-carbamic acid tert-butyl ester Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)CCC1=CNC(=S)N1C2CC3=CC=CC=C3OC2

Isomeric SMILES

CC(C)(C)OC(=O)N(C)CCC1=CNC(=S)N1[C@@H]2CC3=CC=CC=C3OC2

InChI

InChI=1S/C20H27N3O3S/c1-20(2,3)26-19(24)22(4)10-9-15-12-21-18(27)23(15)16-11-14-7-5-6-8-17(14)25-13-16/h5-8,12,16H,9-11,13H2,1-4H3,(H,21,27)/t16-/m1/s1