4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)-N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide Traditional Name: N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]-4-phthalimido-butyramide Formula: C22H18N4O4S2 MolecularWeight: 466.53272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)NC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H18N4O4S2/c27-17(14-7-2-1-3-8-14)13-31-22-25-24-21(32-22)23-18(28)11-6-12-26-19(29)15-9-4-5-10-16(15)20(26)30/h1-5,7-10H,6,11-13H2,(H,23,24,28)