4-(5-naphthalen-1-yl-4-sulfanyl-1,2,3-triazol-1-yl)-6-propyl-benzene-1,3-diol

Systemtic Name: 4-(5-naphthalen-1-yl-4-sulfanyl-1,2,3-triazol-1-yl)-6-propyl-benzene-1,3-diol Openeye Name: 4-[5-(1-naphthyl)-4-sulfanyl-triazol-1-yl]-6-propyl-benzene-1,3-diol CAS Name: 4-[4-mercapto-5-(1-naphthalenyl)-1-triazolyl]-6-propylbenzene-1,3-diol IUPAC Name: 4-(5-naphthalen-1-yl-4-sulfanyltriazol-1-yl)-6-propylbenzene-1,3-diol Traditional Name: 4-[4-mercapto-5-(1-naphthyl)triazol-1-yl]-6-propyl-resorcinol Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1O)O)N2C(=C(N=N2)S)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCC1=CC(=C(C=C1O)O)N2C(=C(N=N2)S)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H19N3O2S/c1-2-6-14-11-17(19(26)12-18(14)25)24-20(21(27)22-23-24)16-10-5-8-13-7-3-4-9-15(13)16/h3-5,7-12,25-27H,2,6H2,1H3