methyl N-[6-[1-oxidanyl-3-oxidanylidene-2-(1-thiophen-2-ylethyl)isoindol-1-yl]-1H-benzimidazol-2-yl]carbamate

Systemtic Name: methyl N-[6-[1-oxidanyl-3-oxidanylidene-2-(1-thiophen-2-ylethyl)isoindol-1-yl]-1H-benzimidazol-2-yl]carbamate Openeye Name: methyl N-[6-[1-hydroxy-3-oxo-2-[1-(2-thienyl)ethyl]isoindolin-1-yl]-1H-benzimidazol-2-yl]carbamate CAS Name: N-[6-[1-hydroxy-3-oxo-2-(1-thiophen-2-ylethyl)-1-isoindolyl]-1H-benzimidazol-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[6-[1-hydroxy-3-oxo-2-(1-thiophen-2-ylethyl)isoindol-1-yl]-1H-benzimidazol-2-yl]carbamate Traditional Name: N-[6-[1-hydroxy-3-keto-2-[1-(2-thienyl)ethyl]isoindolin-1-yl]-1H-benzimidazol-2-yl]carbamic acid methyl ester Formula: C23H20N4O4S MolecularWeight: 448.4943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)N2C(=O)C3=CC=CC=C3C2(C4=CC5=C(C=C4)N=C(N5)NC(=O)OC)O

Isomeric SMILES

CC(C1=CC=CS1)N2C(=O)C3=CC=CC=C3C2(C4=CC5=C(C=C4)N=C(N5)NC(=O)OC)O

InChI

InChI=1S/C23H20N4O4S/c1-13(19-8-5-11-32-19)27-20(28)15-6-3-4-7-16(15)23(27,30)14-9-10-17-18(12-14)25-21(24-17)26-22(29)31-2/h3-13,30H,1-2H3,(H2,24,25,26,29)