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

Systemtic Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-bis(oxidanylidene)-2-(3-phenylpropyl)isoindole-5-carboxamide Openeye Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-2-(3-phenylpropyl)isoindoline-5-carboxamide CAS Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-2-(3-phenylpropyl)-5-isoindolecarboxamide IUPAC Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-2-(3-phenylpropyl)isoindole-5-carboxamide Traditional Name: 1,3-diketo-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(3-phenylpropyl)isoindoline-5-carboxamide Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCC4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C21H18N4O3S/c1-13-23-24-21(29-13)22-18(26)15-9-10-16-17(12-15)20(28)25(19(16)27)11-5-8-14-6-3-2-4-7-14/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H,22,24,26)