2-[4-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]butyl]isoindoline-1,3-quinone Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN=C(S2)SCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN=C(S2)SCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H18N4O2S2/c25-17-15-10-4-5-11-16(15)18(26)24(17)12-6-7-13-27-20-23-22-19(28-20)21-14-8-2-1-3-9-14/h1-5,8-11H,6-7,12-13H2,(H,21,22)