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

Systemtic Name: 1-(3-bromophenyl)carbonyl-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Openeye Name: 1-(3-bromobenzoyl)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide CAS Name: 1-[(3-bromophenyl)-oxomethyl]-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(3-bromobenzoyl)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Traditional Name: 1-(3-bromobenzoyl)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Formula: C22H22BrN5O2S MolecularWeight: 500.41138

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3CCCN3C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3CCCN3C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C22H22BrN5O2S/c1-27(2)17-10-8-14(9-11-17)20-25-26-22(31-20)24-19(29)18-7-4-12-28(18)21(30)15-5-3-6-16(23)13-15/h3,5-6,8-11,13,18H,4,7,12H2,1-2H3,(H,24,26,29)