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

Systemtic Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-ethylphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-ethylbenzoyl)pyrrolidine-2-carboxamide CAS Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-[(4-ethylphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-ethylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-(4-ethylbenzoyl)pyrrolidine-2-carboxamide Formula: C22H21BrN4O2S MolecularWeight: 485.39674

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)NC3=NN=C(S3)C4=CC(=CC=C4)Br

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)NC3=NN=C(S3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C22H21BrN4O2S/c1-2-14-8-10-15(11-9-14)21(29)27-12-4-7-18(27)19(28)24-22-26-25-20(30-22)16-5-3-6-17(23)13-16/h3,5-6,8-11,13,18H,2,4,7,12H2,1H3,(H,24,26,28)