hexyl N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]carbamate

Systemtic Name: hexyl N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]carbamate Openeye Name: hexyl N-(5-benzyl-1,3,4-thiadiazol-2-yl)carbamate CAS Name: N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]carbamic acid hexyl ester IUPAC Name: hexyl N-(5-benzyl-1,3,4-thiadiazol-2-yl)carbamate Traditional Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)carbamic acid hexyl ester Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)NC1=NN=C(S1)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCOC(=O)NC1=NN=C(S1)CC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O2S/c1-2-3-4-8-11-21-16(20)17-15-19-18-14(22-15)12-13-9-6-5-7-10-13/h5-7,9-10H,2-4,8,11-12H2,1H3,(H,17,19,20)