2-[4-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[[2-(3-indolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)thio]butyl]isoindoline-1,3-quinone Formula: C22H18N4O3S MolecularWeight: 418.46832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCSC3=NNC(=C4C=NC5=CC=CC=C54)O3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCSC3=NNC(=C4C=NC5=CC=CC=C54)O3

InChI

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