N-[5-azanyl-4-(1,3-benzothiazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[5-azanyl-4-(1,3-benzothiazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]-3-morpholinosulfonyl-benzamide CAS Name: N-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-amino-3-(1,3-benzothiazol-2-yl)-4-keto-2-pyrrolin-1-yl]-3-morpholinosulfonyl-benzamide Formula: C22H21N5O5S2 MolecularWeight: 499.56264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NN3CC(=O)C(=C3N)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NN3CC(=O)C(=C3N)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H21N5O5S2/c23-20-19(22-24-16-6-1-2-7-18(16)33-22)17(28)13-27(20)25-21(29)14-4-3-5-15(12-14)34(30,31)26-8-10-32-11-9-26/h1-7,12H,8-11,13,23H2,(H,25,29)