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

Systemtic Name: N-[3-oxidanylidene-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1,2-dihydroinden-5-yl]dodecanamide Openeye Name: N-[3-oxo-2-(1-phenyltetrazol-5-yl)sulfanyl-indan-5-yl]dodecanamide CAS Name: N-[3-oxo-2-[(1-phenyl-5-tetrazolyl)thio]-1,2-dihydroinden-5-yl]dodecanamide IUPAC Name: N-[3-oxo-2-(1-phenyltetrazol-5-yl)sulfanyl-1,2-dihydroinden-5-yl]dodecanamide Traditional Name: N-[3-keto-2-[(1-phenyltetrazol-5-yl)thio]indan-5-yl]lauramide Formula: C28H35N5O2S MolecularWeight: 505.6748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H35N5O2S/c1-2-3-4-5-6-7-8-9-13-16-26(34)29-22-18-17-21-19-25(27(35)24(21)20-22)36-28-30-31-32-33(28)23-14-11-10-12-15-23/h10-12,14-15,17-18,20,25H,2-9,13,16,19H2,1H3,(H,29,34)