2-bromanyl-N-[5-[(3R)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[5-[(3R)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 2-bromo-N-[5-[(3R)-5-oxo-1-(p-tolyl)pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 2-bromo-N-[5-[(3R)-1-(4-methylphenyl)-5-oxo-3-pyrrolidinyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 2-bromo-N-[5-[(3R)-1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 2-bromo-N-[5-[(3R)-5-keto-1-(p-tolyl)pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide Formula: C20H17BrN4O2S MolecularWeight: 457.34358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C3=NN=C(S3)NC(=O)C4=CC=CC=C4Br

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@@H](CC2=O)C3=NN=C(S3)NC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C20H17BrN4O2S/c1-12-6-8-14(9-7-12)25-11-13(10-17(25)26)19-23-24-20(28-19)22-18(27)15-4-2-3-5-16(15)21/h2-9,13H,10-11H2,1H3,(H,22,24,27)/t13-/m1/s1