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

Systemtic Name: 1-(3-bromophenyl)carbonyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Openeye Name: 1-(3-bromobenzoyl)-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide CAS Name: 1-[(3-bromophenyl)-oxomethyl]-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(3-bromobenzoyl)-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Traditional Name: 1-(3-bromobenzoyl)-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Formula: C21H19BrN4O2S MolecularWeight: 471.37016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C3CCCN3C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C3CCCN3C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H19BrN4O2S/c1-13-5-2-6-14(11-13)19-24-25-21(29-19)23-18(27)17-9-4-10-26(17)20(28)15-7-3-8-16(22)12-15/h2-3,5-8,11-12,17H,4,9-10H2,1H3,(H,23,25,27)