2-chloranyl-N-[5-[1-(2-ethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[5-[1-(2-ethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 2-chloro-N-[5-[1-(2-ethylphenyl)-5-oxo-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 2-chloro-N-[5-[1-(2-ethylphenyl)-5-oxo-3-pyrrolidinyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 2-chloro-N-[5-[1-(2-ethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 2-chloro-N-[5-[1-(2-ethylphenyl)-5-keto-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide Formula: C21H19ClN4O2S MolecularWeight: 426.91916

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2CC(CC2=O)C3=NN=C(S3)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

CCC1=CC=CC=C1N2CC(CC2=O)C3=NN=C(S3)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H19ClN4O2S/c1-2-13-7-3-6-10-17(13)26-12-14(11-18(26)27)20-24-25-21(29-20)23-19(28)15-8-4-5-9-16(15)22/h3-10,14H,2,11-12H2,1H3,(H,23,25,28)