1,3-bis(oxidanylidene)-2-(1-phenylethyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)isoindole-5-carboxamide

Systemtic Name: 1,3-bis(oxidanylidene)-2-(1-phenylethyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)isoindole-5-carboxamide Openeye Name: 1,3-dioxo-2-(1-phenylethyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)isoindoline-5-carboxamide CAS Name: 1,3-dioxo-2-(1-phenylethyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)-5-isoindolecarboxamide IUPAC Name: 1,3-dioxo-2-(1-phenylethyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)isoindole-5-carboxamide Traditional Name: 1,3-diketo-2-(1-phenylethyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)isoindoline-5-carboxamide Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C(C)C4=CC=CC=C4

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C(C)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O3S/c1-3-7-18-24-25-22(30-18)23-19(27)15-10-11-16-17(12-15)21(29)26(20(16)28)13(2)14-8-5-4-6-9-14/h4-6,8-13H,3,7H2,1-2H3,(H,23,25,27)