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

Systemtic Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-pentylphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-pentylbenzoyl)pyrrolidine-2-carboxamide CAS Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-[oxo-(4-pentylphenyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-pentylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: 1-(4-amylbenzoyl)-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Formula: C25H27BrN4O2S MolecularWeight: 527.47648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27BrN4O2S/c1-2-3-4-6-17-8-10-19(11-9-17)24(32)30-16-5-7-21(30)22(31)27-25-29-28-23(33-25)18-12-14-20(26)15-13-18/h8-15,21H,2-7,16H2,1H3,(H,27,29,31)