N-[5-[(4-tert-butylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[5-[(4-tert-butylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[5-[(4-tert-butylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(2-thienyl)acetamide CAS Name: N-[5-[(4-tert-butylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2-thiophen-2-ylacetamide IUPAC Name: N-[5-[(4-tert-butylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-thiophen-2-ylacetamide Traditional Name: N-[5-[(4-tert-butylbenzyl)thio]-1,3,4-thiadiazol-2-yl]-2-(2-thienyl)acetamide Formula: C19H21N3OS3 MolecularWeight: 403.58454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CC3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CC3=CC=CS3

InChI

InChI=1S/C19H21N3OS3/c1-19(2,3)14-8-6-13(7-9-14)12-25-18-22-21-17(26-18)20-16(23)11-15-5-4-10-24-15/h4-10H,11-12H2,1-3H3,(H,20,21,23)