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

Systemtic Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-(2-methoxyphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-(2-methoxybenzoyl)pyrrolidine-2-carboxamide CAS Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-[(2-methoxyphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-(2-methoxybenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-o-anisoyl-pyrrolidine-2-carboxamide Formula: C21H19BrN4O3S MolecularWeight: 487.36956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)N2CCCC2C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=CC=C1C(=O)N2CCCC2C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H19BrN4O3S/c1-29-17-7-3-2-5-15(17)20(28)26-12-4-6-16(26)18(27)23-21-25-24-19(30-21)13-8-10-14(22)11-9-13/h2-3,5,7-11,16H,4,6,12H2,1H3,(H,23,25,27)