3-[1-phenylethyl(2-phenylsulfanylethanoyl)amino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 3-[1-phenylethyl(2-phenylsulfanylethanoyl)amino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 3-[1-phenylethyl-(2-phenylsulfanylacetyl)amino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 3-[[1-oxo-2-(phenylthio)ethyl]-(1-phenylethyl)amino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-[1-phenylethyl-(2-phenylsulfanylacetyl)amino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 3-[1-phenylethyl-[2-(phenylthio)acetyl]amino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)propionamide Formula: C27H26N4O2S2 MolecularWeight: 502.65094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CCC(=O)NC2=NN=C(S2)C3=CC=CC=C3)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=CC=C1)N(CCC(=O)NC2=NN=C(S2)C3=CC=CC=C3)C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C27H26N4O2S2/c1-20(21-11-5-2-6-12-21)31(25(33)19-34-23-15-9-4-10-16-23)18-17-24(32)28-27-30-29-26(35-27)22-13-7-3-8-14-22/h2-16,20H,17-19H2,1H3,(H,28,30,32)