N-[2-(ethylamino)-5-morpholin-4-ylsulfonyl-phenyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[2-(ethylamino)-5-morpholin-4-ylsulfonyl-phenyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-[2-(ethylamino)-5-morpholinosulfonyl-phenyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[2-(ethylamino)-5-(4-morpholinylsulfonyl)phenyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[2-(ethylamino)-5-morpholin-4-ylsulfonylphenyl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-[2-(ethylamino)-5-morpholinosulfonyl-phenyl]-1,3-benzothiazole-6-carboxamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CCNC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C20H22N4O4S2/c1-2-21-16-6-4-15(30(26,27)24-7-9-28-10-8-24)12-18(16)23-20(25)14-3-5-17-19(11-14)29-13-22-17/h3-6,11-13,21H,2,7-10H2,1H3,(H,23,25)