2-chloranyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-morpholinosulfonyl-benzamide CAS Name: 2-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-morpholin-4-ylsulfonylbenzamide Traditional Name: 2-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-morpholinosulfonyl-benzamide Formula: C20H20ClN3O5S2 MolecularWeight: 481.9729

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

InChI

InChI=1S/C20H20ClN3O5S2/c1-2-29-13-3-6-17-18(11-13)30-20(22-17)23-19(25)15-12-14(4-5-16(15)21)31(26,27)24-7-9-28-10-8-24/h3-6,11-12H,2,7-10H2,1H3,(H,22,23,25)