N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-pentylphenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-pentylphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-pentylbenzoyl)pyrrolidine-2-carboxamide CAS Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-[oxo-(4-pentylphenyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-pentylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: 1-(4-amylbenzoyl)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Formula: C27H33N5O2S MolecularWeight: 491.64822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C27H33N5O2S/c1-4-5-6-8-19-10-12-21(13-11-19)26(34)32-18-7-9-23(32)24(33)28-27-30-29-25(35-27)20-14-16-22(17-15-20)31(2)3/h10-17,23H,4-9,18H2,1-3H3,(H,28,30,33)