4-ethyl-6-[5-(6-methoxynaphthalen-1-yl)-4-sulfanyl-1,2,3-triazol-1-yl]benzene-1,3-diol

Systemtic Name: 4-ethyl-6-[5-(6-methoxynaphthalen-1-yl)-4-sulfanyl-1,2,3-triazol-1-yl]benzene-1,3-diol Openeye Name: 4-ethyl-6-[5-(6-methoxy-1-naphthyl)-4-sulfanyl-triazol-1-yl]benzene-1,3-diol CAS Name: 4-ethyl-6-[4-mercapto-5-(6-methoxy-1-naphthalenyl)-1-triazolyl]benzene-1,3-diol IUPAC Name: 4-ethyl-6-[5-(6-methoxynaphthalen-1-yl)-4-sulfanyltriazol-1-yl]benzene-1,3-diol Traditional Name: 4-ethyl-6-[4-mercapto-5-(6-methoxy-1-naphthyl)triazol-1-yl]resorcinol Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1O)O)N2C(=C(N=N2)S)C3=CC=CC4=C3C=CC(=C4)OC

Isomeric SMILES

CCC1=CC(=C(C=C1O)O)N2C(=C(N=N2)S)C3=CC=CC4=C3C=CC(=C4)OC

InChI

InChI=1S/C21H19N3O3S/c1-3-12-10-17(19(26)11-18(12)25)24-20(21(28)22-23-24)16-6-4-5-13-9-14(27-2)7-8-15(13)16/h4-11,25-26,28H,3H2,1-2H3