2-[3-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)thio]propyl]isoindoline-1,3-quinone Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CC2)SCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)C1=NN=C(N1C2CC2)SCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H22N4O2S/c1-12(2)16-20-21-19(23(16)13-8-9-13)26-11-5-10-22-17(24)14-6-3-4-7-15(14)18(22)25/h3-4,6-7,12-13H,5,8-11H2,1-2H3