tert-butyl N-[[6-(5-aminocarbonyl-4-methyl-1,3-thiazol-2-yl)-2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-isoquinolin-3-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[6-(5-aminocarbonyl-4-methyl-1,3-thiazol-2-yl)-2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-isoquinolin-3-yl]methyl]carbamate Openeye Name: tert-butyl N-[[6-(5-carbamoyl-4-methyl-thiazol-2-yl)-2-isobutyl-1-oxo-4-phenyl-3-isoquinolyl]methyl]carbamate CAS Name: N-[[6-(5-carbamoyl-4-methyl-2-thiazolyl)-2-(2-methylpropyl)-1-oxo-4-phenyl-3-isoquinolinyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[6-(5-carbamoyl-4-methyl-1,3-thiazol-2-yl)-2-(2-methylpropyl)-1-oxo-4-phenylisoquinolin-3-yl]methyl]carbamate Traditional Name: N-[[6-(5-carbamoyl-4-methyl-thiazol-2-yl)-2-isobutyl-1-keto-4-phenyl-3-isoquinolyl]methyl]carbamic acid tert-butyl ester Formula: C30H34N4O4S MolecularWeight: 546.68036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC3=C(C=C2)C(=O)N(C(=C3C4=CC=CC=C4)CNC(=O)OC(C)(C)C)CC(C)C)C(=O)N

Isomeric SMILES

CC1=C(SC(=N1)C2=CC3=C(C=C2)C(=O)N(C(=C3C4=CC=CC=C4)CNC(=O)OC(C)(C)C)CC(C)C)C(=O)N

InChI

InChI=1S/C30H34N4O4S/c1-17(2)16-34-23(15-32-29(37)38-30(4,5)6)24(19-10-8-7-9-11-19)22-14-20(12-13-21(22)28(34)36)27-33-18(3)25(39-27)26(31)35/h7-14,17H,15-16H2,1-6H3,(H2,31,35)(H,32,37)