N-[3-oxidanylidene-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1,2-dihydroinden-5-yl]octadecanamide

Systemtic Name: N-[3-oxidanylidene-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1,2-dihydroinden-5-yl]octadecanamide Openeye Name: N-[3-oxo-2-(1-phenyltetrazol-5-yl)sulfanyl-indan-5-yl]octadecanamide CAS Name: N-[3-oxo-2-[(1-phenyl-5-tetrazolyl)thio]-1,2-dihydroinden-5-yl]octadecanamide IUPAC Name: N-[3-oxo-2-(1-phenyltetrazol-5-yl)sulfanyl-1,2-dihydroinden-5-yl]octadecanamide Traditional Name: N-[3-keto-2-[(1-phenyltetrazol-5-yl)thio]indan-5-yl]stearamide Formula: C34H47N5O2S MolecularWeight: 589.83428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC1=CC2=C(CC(C2=O)SC3=NN=NN3C4=CC=CC=C4)C=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC1=CC2=C(CC(C2=O)SC3=NN=NN3C4=CC=CC=C4)C=C1

InChI

InChI=1S/C34H47N5O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-32(40)35-28-24-23-27-25-31(33(41)30(27)26-28)42-34-36-37-38-39(34)29-20-17-16-18-21-29/h16-18,20-21,23-24,26,31H,2-15,19,22,25H2,1H3,(H,35,40)