N-(1,3-benzothiazol-2-ylmethyl)-2-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-methoxy-3-morpholinosulfonyl-phenyl)acetamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-methoxy-3-morpholinosulfonyl-phenyl)acetamide Formula: C21H23N3O5S2 MolecularWeight: 461.55442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NCC2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NCC2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H23N3O5S2/c1-28-17-7-6-15(12-19(17)31(26,27)24-8-10-29-11-9-24)13-20(25)22-14-21-23-16-4-2-3-5-18(16)30-21/h2-7,12H,8-11,13-14H2,1H3,(H,22,25)