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

Systemtic Name: 2-[4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-(1-phenyltetrazol-5-yl)sulfanylbutyl]isoindoline-1,3-dione CAS Name: 2-[4-[(1-phenyl-5-tetrazolyl)thio]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(1-phenyltetrazol-5-yl)sulfanylbutyl]isoindole-1,3-dione Traditional Name: 2-[4-[(1-phenyltetrazol-5-yl)thio]butyl]isoindoline-1,3-quinone Formula: C19H17N5O2S MolecularWeight: 379.43558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H17N5O2S/c25-17-15-10-4-5-11-16(15)18(26)23(17)12-6-7-13-27-19-20-21-22-24(19)14-8-2-1-3-9-14/h1-5,8-11H,6-7,12-13H2