3-(1-azanylbutan-2-yloxy)-5-(4-methylsulfonylphenoxy)-N-(1,3-thiazol-2-yl)benzamide

Systemtic Name: 3-(1-azanylbutan-2-yloxy)-5-(4-methylsulfonylphenoxy)-N-(1,3-thiazol-2-yl)benzamide Openeye Name: 3-[1-(aminomethyl)propoxy]-5-(4-methylsulfonylphenoxy)-N-thiazol-2-yl-benzamide CAS Name: 3-(1-aminobutan-2-yloxy)-5-(4-methylsulfonylphenoxy)-N-(2-thiazolyl)benzamide IUPAC Name: 3-(1-aminobutan-2-yloxy)-5-(4-methylsulfonylphenoxy)-N-(1,3-thiazol-2-yl)benzamide Traditional Name: 3-[1-(aminomethyl)propoxy]-5-(4-mesylphenoxy)-N-thiazol-2-yl-benzamide Formula: C21H23N3O5S2 MolecularWeight: 461.55442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CN)OC1=CC(=CC(=C1)OC2=CC=C(C=C2)S(=O)(=O)C)C(=O)NC3=NC=CS3

Isomeric SMILES

CCC(CN)OC1=CC(=CC(=C1)OC2=CC=C(C=C2)S(=O)(=O)C)C(=O)NC3=NC=CS3

InChI

InChI=1S/C21H23N3O5S2/c1-3-15(13-22)28-17-10-14(20(25)24-21-23-8-9-30-21)11-18(12-17)29-16-4-6-19(7-5-16)31(2,26)27/h4-12,15H,3,13,22H2,1-2H3,(H,23,24,25)