tert-butyl N-(1-oxidanylidene-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl)carbamate

Systemtic Name: tert-butyl N-(1-oxidanylidene-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl)carbamate Openeye Name: tert-butyl N-(1-oxo-3-thioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl)carbamate CAS Name: N-(1-oxo-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(1-oxo-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl)carbamate Traditional Name: N-(1-keto-3-thioxo-10,10a-dihydro-5H-imidaz[1,5-b]isoquinolin-2-yl)carbamic acid tert-butyl ester Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN1C(=O)C2CC3=CC=CC=C3CN2C1=S

Isomeric SMILES

CC(C)(C)OC(=O)NN1C(=O)C2CC3=CC=CC=C3CN2C1=S

InChI

InChI=1S/C16H19N3O3S/c1-16(2,3)22-14(21)17-19-13(20)12-8-10-6-4-5-7-11(10)9-18(12)15(19)23/h4-7,12H,8-9H2,1-3H3,(H,17,21)