[2-[(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)carbamoyl]phenyl] ethanoate

Systemtic Name: [2-[(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)carbamoyl]phenyl] ethanoate Openeye Name: [2-[(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)carbamoyl]phenyl] acetate CAS Name: acetic acid [2-[oxo-[[6-(1-pyrrolidinylsulfonyl)-1,3-benzothiazol-2-yl]amino]methyl]phenyl] ester IUPAC Name: [2-[(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)carbamoyl]phenyl] acetate Traditional Name: acetic acid [2-[(6-pyrrolidinosulfonyl-1,3-benzothiazol-2-yl)carbamoyl]phenyl] ester Formula: C20H19N3O5S2 MolecularWeight: 445.51196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H19N3O5S2/c1-13(24)28-17-7-3-2-6-15(17)19(25)22-20-21-16-9-8-14(12-18(16)29-20)30(26,27)23-10-4-5-11-23/h2-3,6-9,12H,4-5,10-11H2,1H3,(H,21,22,25)