N-(6-acetamido-1,3-benzothiazol-2-yl)-3-[4-(cyclopropylsulfamoyl)phenyl]propanamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-3-[4-(cyclopropylsulfamoyl)phenyl]propanamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-3-[4-(cyclopropylsulfamoyl)phenyl]propanamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-3-[4-(cyclopropylsulfamoyl)phenyl]propanamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-3-[4-(cyclopropylsulfamoyl)phenyl]propanamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-3-[4-(cyclopropylsulfamoyl)phenyl]propionamide Formula: C21H22N4O4S2 MolecularWeight: 458.55378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CC=C(C=C3)S(=O)(=O)NC4CC4

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CC=C(C=C3)S(=O)(=O)NC4CC4

InChI

InChI=1S/C21H22N4O4S2/c1-13(26)22-16-7-10-18-19(12-16)30-21(23-18)24-20(27)11-4-14-2-8-17(9-3-14)31(28,29)25-15-5-6-15/h2-3,7-10,12,15,25H,4-6,11H2,1H3,(H,22,26)(H,23,24,27)