3-phenylbutyl N-[(4-phenyl-1,2,3-thiadiazol-5-yl)carbonylamino]carbamate

Systemtic Name: 3-phenylbutyl N-[(4-phenyl-1,2,3-thiadiazol-5-yl)carbonylamino]carbamate Openeye Name: 3-phenylbutyl N-[(4-phenylthiadiazole-5-carbonyl)amino]carbamate CAS Name: N-[[oxo-(4-phenyl-5-thiadiazolyl)methyl]amino]carbamic acid 3-phenylbutyl ester IUPAC Name: 3-phenylbutyl N-[(4-phenylthiadiazole-5-carbonyl)amino]carbamate Traditional Name: N-[(4-phenylthiadiazole-5-carbonyl)amino]carbamic acid 3-phenylbutyl ester Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=O)NNC(=O)C1=C(N=NS1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(CCOC(=O)NNC(=O)C1=C(N=NS1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N4O3S/c1-14(15-8-4-2-5-9-15)12-13-27-20(26)23-22-19(25)18-17(21-24-28-18)16-10-6-3-7-11-16/h2-11,14H,12-13H2,1H3,(H,22,25)(H,23,26)