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

Systemtic Name: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3-[1-phenylethyl(2-phenylsulfanylethanoyl)amino]propanamide Openeye Name: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3-[1-phenylethyl-(2-phenylsulfanylacetyl)amino]propanamide CAS Name: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3-[[1-oxo-2-(phenylthio)ethyl]-(1-phenylethyl)amino]propanamide IUPAC Name: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3-[1-phenylethyl-(2-phenylsulfanylacetyl)amino]propanamide Traditional Name: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3-[1-phenylethyl-[2-(phenylthio)acetyl]amino]propionamide Formula: C27H25ClN4O2S2 MolecularWeight: 537.096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25ClN4O2S2/c1-19(20-8-4-2-5-9-20)32(25(34)18-35-23-10-6-3-7-11-23)17-16-24(33)29-27-31-30-26(36-27)21-12-14-22(28)15-13-21/h2-15,19H,16-18H2,1H3,(H,29,31,33)