ethyl 1-[3-(2-hydroxyphenyl)phenyl]-6-methylsulfanyl-7-propan-2-ylsulfonyl-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate

Systemtic Name: ethyl 1-[3-(2-hydroxyphenyl)phenyl]-6-methylsulfanyl-7-propan-2-ylsulfonyl-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate Openeye Name: ethyl 1-[3-(2-hydroxyphenyl)phenyl]-7-isopropylsulfonyl-6-methylsulfanyl-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate CAS Name: 1-[3-(2-hydroxyphenyl)phenyl]-6-(methylthio)-7-propan-2-ylsulfonyl-3-(1,2,4-triazol-1-ylmethyl)-2-naphthalenecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2-hydroxyphenyl)phenyl]-6-methylsulfanyl-7-propan-2-ylsulfonyl-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate Traditional Name: 1-[3-(2-hydroxyphenyl)phenyl]-7-isopropylsulfonyl-6-(methylthio)-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylic acid ethyl ester Formula: C32H31N3O5S2 MolecularWeight: 601.73564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C2C=C(C(=CC2=C1C3=CC=CC(=C3)C4=CC=CC=C4O)S(=O)(=O)C(C)C)SC)CN5C=NC=N5

Isomeric SMILES

CCOC(=O)C1=C(C=C2C=C(C(=CC2=C1C3=CC=CC(=C3)C4=CC=CC=C4O)S(=O)(=O)C(C)C)SC)CN5C=NC=N5

InChI

InChI=1S/C32H31N3O5S2/c1-5-40-32(37)31-24(17-35-19-33-18-34-35)14-23-15-28(41-4)29(42(38,39)20(2)3)16-26(23)30(31)22-10-8-9-21(13-22)25-11-6-7-12-27(25)36/h6-16,18-20,36H,5,17H2,1-4H3