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

Systemtic Name: 2-(4-methoxyphenyl)-1,3-bis(oxidanylidene)-N-(5-propyl-1,3,4-thiadiazol-2-yl)isoindole-5-carboxamide Openeye Name: 2-(4-methoxyphenyl)-1,3-dioxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)isoindoline-5-carboxamide CAS Name: 2-(4-methoxyphenyl)-1,3-dioxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)-5-isoindolecarboxamide IUPAC Name: 2-(4-methoxyphenyl)-1,3-dioxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)isoindole-5-carboxamide Traditional Name: 1,3-diketo-2-(4-methoxyphenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)isoindoline-5-carboxamide Formula: C21H18N4O4S MolecularWeight: 422.45702

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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)C4=CC=C(C=C4)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H18N4O4S/c1-3-4-17-23-24-21(30-17)22-18(26)12-5-10-15-16(11-12)20(28)25(19(15)27)13-6-8-14(29-2)9-7-13/h5-11H,3-4H2,1-2H3,(H,22,24,26)