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

Systemtic Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-1,3-bis(oxidanylidene)-2-phenethyl-isoindole-5-carboxamide Openeye Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-2-phenethyl-isoindoline-5-carboxamide CAS Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-2-phenethyl-5-isoindolecarboxamide IUPAC Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-2-phenethylisoindole-5-carboxamide Traditional Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-1,3-diketo-2-phenethyl-isoindoline-5-carboxamide Formula: C22H18N4O3S MolecularWeight: 418.46832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CCC5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NN=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CCC5=CC=CC=C5

InChI

InChI=1S/C22H18N4O3S/c27-18(23-22-25-24-19(30-22)14-6-7-14)15-8-9-16-17(12-15)21(29)26(20(16)28)11-10-13-4-2-1-3-5-13/h1-5,8-9,12,14H,6-7,10-11H2,(H,23,25,27)