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

Systemtic Name: 2-[2-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(1-isopropyltetrazol-5-yl)sulfanylethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(1-propan-2-yl-5-tetrazolyl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(1-propan-2-yltetrazol-5-yl)sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(1-isopropyltetrazol-5-yl)thio]ethyl]isoindoline-1,3-quinone Formula: C14H15N5O2S MolecularWeight: 317.3662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=N1)SCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)N1C(=NN=N1)SCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C14H15N5O2S/c1-9(2)19-14(15-16-17-19)22-8-7-18-12(20)10-5-3-4-6-11(10)13(18)21/h3-6,9H,7-8H2,1-2H3