tert-butyl N-[[4-[[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]carbamoyl]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]carbamoyl]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[[3-(2-thioxo-1H-imidazol-3-yl)phenyl]carbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[oxo-[3-(2-sulfanylidene-1H-imidazol-3-yl)anilino]methyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]carbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[[3-(2-thioxo-4-imidazolin-1-yl)phenyl]carbamoyl]benzyl]carbamic acid tert-butyl ester Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)N3C=CNC3=S

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)N3C=CNC3=S

InChI

InChI=1S/C22H24N4O3S/c1-22(2,3)29-21(28)24-14-15-7-9-16(10-8-15)19(27)25-17-5-4-6-18(13-17)26-12-11-23-20(26)30/h4-13H,14H2,1-3H3,(H,23,30)(H,24,28)(H,25,27)