1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Openeye Name: 1-(3-chloro-4-methyl-phenyl)-5-oxo-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide CAS Name: 1-(3-chloro-4-methylphenyl)-5-oxo-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(3-chloro-4-methylphenyl)-5-oxo-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Traditional Name: 1-(3-chloro-4-methyl-phenyl)-5-keto-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Formula: C23H23ClN4O2S2 MolecularWeight: 487.03732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=NN=C(S3)SCCCC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=NN=C(S3)SCCCC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H23ClN4O2S2/c1-15-9-10-18(13-19(15)24)28-14-17(12-20(28)29)21(30)25-22-26-27-23(32-22)31-11-5-8-16-6-3-2-4-7-16/h2-4,6-7,9-10,13,17H,5,8,11-12,14H2,1H3,(H,25,26,30)