tert-butyl N-[1-oxidanylidene-4-phenyl-1-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-oxidanylidene-4-phenyl-1-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]butan-2-yl]carbamate Openeye Name: tert-butyl N-[3-phenyl-1-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoyl]propyl]carbamate CAS Name: N-[1-oxo-4-phenyl-1-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]butan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-oxo-4-phenyl-1-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]butan-2-yl]carbamate Traditional Name: N-[3-phenyl-1-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoyl]propyl]carbamic acid tert-butyl ester Formula: C17H22N4O3S2 MolecularWeight: 394.51158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC1=CC=CC=C1)C(=O)NC2=NNC(=S)S2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCC1=CC=CC=C1)C(=O)NC2=NNC(=S)S2

InChI

InChI=1S/C17H22N4O3S2/c1-17(2,3)24-15(23)18-12(10-9-11-7-5-4-6-8-11)13(22)19-14-20-21-16(25)26-14/h4-8,12H,9-10H2,1-3H3,(H,18,23)(H,21,25)(H,19,20,22)