2-[3-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)propyl]isoindole-1,3-dione Openeye Name: 2-[3-[5-oxo-4-(2-thienyl)tetrazol-1-yl]propyl]isoindoline-1,3-dione CAS Name: 2-[3-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(5-oxo-4-thiophen-2-yltetrazol-1-yl)propyl]isoindole-1,3-dione Traditional Name: 2-[3-[5-keto-4-(2-thienyl)tetrazol-1-yl]propyl]isoindoline-1,3-quinone Formula: C16H13N5O3S MolecularWeight: 355.37112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCN3C(=O)N(N=N3)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCN3C(=O)N(N=N3)C4=CC=CS4

InChI

InChI=1S/C16H13N5O3S/c22-14-11-5-1-2-6-12(11)15(23)19(14)8-4-9-20-16(24)21(18-17-20)13-7-3-10-25-13/h1-3,5-7,10H,4,8-9H2