2-[[5-(3-morpholin-4-ylsulfonylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole

Systemtic Name: 2-[[5-(3-morpholin-4-ylsulfonylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole Openeye Name: 2-[[4-allyl-5-(3-morpholinosulfonylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole CAS Name: 2-[[[5-[3-(4-morpholinylsulfonyl)phenyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzoxazole IUPAC Name: 2-[[5-(3-morpholin-4-ylsulfonylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole Traditional Name: 2-[[[4-allyl-5-(3-morpholinosulfonylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzoxazole Formula: C23H23N5O4S2 MolecularWeight: 497.58982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=NC3=CC=CC=C3O2)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=NC3=CC=CC=C3O2)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C23H23N5O4S2/c1-2-10-28-22(17-6-5-7-18(15-17)34(29,30)27-11-13-31-14-12-27)25-26-23(28)33-16-21-24-19-8-3-4-9-20(19)32-21/h2-9,15H,1,10-14,16H2