tert-butyl N-[[4-[(5-pentyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[(5-pentyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[(5-pentyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[oxo-[(5-pentyl-1,3,4-thiadiazol-2-yl)amino]methyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[(5-pentyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[(5-amyl-1,3,4-thiadiazol-2-yl)carbamoyl]benzyl]carbamic acid tert-butyl ester Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)CNC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C20H28N4O3S/c1-5-6-7-8-16-23-24-18(28-16)22-17(25)15-11-9-14(10-12-15)13-21-19(26)27-20(2,3)4/h9-12H,5-8,13H2,1-4H3,(H,21,26)(H,22,24,25)