1-(4-tert-butylphenyl)carbonyl-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-tert-butylphenyl)carbonyl-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Openeye Name: 1-(4-tert-butylbenzoyl)-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide CAS Name: 1-[(4-tert-butylphenyl)-oxomethyl]-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-tert-butylbenzoyl)-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Traditional Name: 1-(4-tert-butylbenzoyl)-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Formula: C24H25ClN4O2S MolecularWeight: 468.9989

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25ClN4O2S/c1-24(2,3)17-11-9-15(10-12-17)22(31)29-13-5-8-19(29)20(30)26-23-28-27-21(32-23)16-6-4-7-18(25)14-16/h4,6-7,9-12,14,19H,5,8,13H2,1-3H3,(H,26,28,30)