N-(7-chloranyl-3-ethyl-4-methyl-1,3-benzothiazol-2-ylidene)-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(7-chloranyl-3-ethyl-4-methyl-1,3-benzothiazol-2-ylidene)-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(7-chloro-3-ethyl-4-methyl-1,3-benzothiazol-2-ylidene)-4-morpholinosulfonyl-benzamide CAS Name: N-(7-chloro-3-ethyl-4-methyl-1,3-benzothiazol-2-ylidene)-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(7-chloro-3-ethyl-4-methyl-1,3-benzothiazol-2-ylidene)-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(7-chloro-3-ethyl-4-methyl-1,3-benzothiazol-2-ylidene)-4-morpholinosulfonyl-benzamide Formula: C21H22ClN3O4S2 MolecularWeight: 480.00008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)Cl)C

Isomeric SMILES

CCN1C2=C(C=CC(=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)Cl)C

InChI

InChI=1S/C21H22ClN3O4S2/c1-3-25-18-14(2)4-9-17(22)19(18)30-21(25)23-20(26)15-5-7-16(8-6-15)31(27,28)24-10-12-29-13-11-24/h4-9H,3,10-13H2,1-2H3