N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-4-phenyl-benzamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-4-phenyl-benzamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-4-phenyl-benzamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-4-phenylbenzamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-4-phenylbenzamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-4-phenyl-benzamide Formula: C27H27N3O4S2 MolecularWeight: 521.65098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N(CCN3CCOCC3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N(CCN3CCOCC3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N3O4S2/c1-36(32,33)23-11-12-24-25(19-23)35-27(28-24)30(14-13-29-15-17-34-18-16-29)26(31)22-9-7-21(8-10-22)20-5-3-2-4-6-20/h2-12,19H,13-18H2,1H3