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

Systemtic Name: 2-[2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)thio]ethyl]isoindoline-1,3-quinone Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CC2)SCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)C1=NN=C(N1C2CC2)SCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C18H20N4O2S/c1-11(2)15-19-20-18(22(15)12-7-8-12)25-10-9-21-16(23)13-5-3-4-6-14(13)17(21)24/h3-6,11-12H,7-10H2,1-2H3