3-morpholin-4-ylsulfonyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 3-morpholin-4-ylsulfonyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 3-morpholinosulfonyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-(4-morpholinylsulfonyl)-N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-morpholin-4-ylsulfonyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 3-morpholinosulfonyl-N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C21H20N4O5S3 MolecularWeight: 504.6023

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NN=C(S3)SCC(=O)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NN=C(S3)SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O5S3/c26-18(15-5-2-1-3-6-15)14-31-21-24-23-20(32-21)22-19(27)16-7-4-8-17(13-16)33(28,29)25-9-11-30-12-10-25/h1-8,13H,9-12,14H2,(H,22,23,27)