1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl ester IUPAC Name: 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(O1)C2=CC=CC=C2)OC(=O)C3=C(SC4=C3CCCC4)NC(=O)C

Isomeric SMILES

CC(C1=NN=C(O1)C2=CC=CC=C2)OC(=O)C3=C(SC4=C3CCCC4)NC(=O)C

InChI

InChI=1S/C21H21N3O4S/c1-12(18-23-24-19(28-18)14-8-4-3-5-9-14)27-21(26)17-15-10-6-7-11-16(15)29-20(17)22-13(2)25/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,22,25)