ethyl 6-fluoranyl-7-propan-2-ylsulfonyl-1-(3-propan-2-ylsulfonylphenyl)-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate

Systemtic Name: ethyl 6-fluoranyl-7-propan-2-ylsulfonyl-1-(3-propan-2-ylsulfonylphenyl)-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate Openeye Name: ethyl 6-fluoro-7-isopropylsulfonyl-1-(3-isopropylsulfonylphenyl)-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate CAS Name: 6-fluoro-7-propan-2-ylsulfonyl-1-(3-propan-2-ylsulfonylphenyl)-3-(1,2,4-triazol-1-ylmethyl)-2-naphthalenecarboxylic acid ethyl ester IUPAC Name: ethyl 6-fluoro-7-propan-2-ylsulfonyl-1-(3-propan-2-ylsulfonylphenyl)-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate Traditional Name: 6-fluoro-7-isopropylsulfonyl-1-(3-isopropylsulfonylphenyl)-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylic acid ethyl ester Formula: C28H30FN3O6S2 MolecularWeight: 587.682703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C2C=C(C(=CC2=C1C3=CC(=CC=C3)S(=O)(=O)C(C)C)S(=O)(=O)C(C)C)F)CN4C=NC=N4

Isomeric SMILES

CCOC(=O)C1=C(C=C2C=C(C(=CC2=C1C3=CC(=CC=C3)S(=O)(=O)C(C)C)S(=O)(=O)C(C)C)F)CN4C=NC=N4

InChI

InChI=1S/C28H30FN3O6S2/c1-6-38-28(33)27-21(14-32-16-30-15-31-32)10-20-12-24(29)25(40(36,37)18(4)5)13-23(20)26(27)19-8-7-9-22(11-19)39(34,35)17(2)3/h7-13,15-18H,6,14H2,1-5H3