2-[[5-[(4-propan-2-ylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-prop-2-ynyl-ethanamide

Systemtic Name: 2-[[5-[(4-propan-2-ylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-prop-2-ynyl-ethanamide Openeye Name: 2-[[5-(4-isopropylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-prop-2-ynyl-acetamide CAS Name: 2-[[5-(4-propan-2-ylanilino)-1,3,4-thiadiazol-2-yl]thio]-N-prop-2-ynylacetamide IUPAC Name: 2-[[5-(4-propan-2-ylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-prop-2-ynylacetamide Traditional Name: 2-[(5-cumidino-1,3,4-thiadiazol-2-yl)thio]-N-propargyl-acetamide Formula: C16H18N4OS2 MolecularWeight: 346.47032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)NCC#C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)NCC#C

InChI

InChI=1S/C16H18N4OS2/c1-4-9-17-14(21)10-22-16-20-19-15(23-16)18-13-7-5-12(6-8-13)11(2)3/h1,5-8,11H,9-10H2,2-3H3,(H,17,21)(H,18,19)