N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-2-(phenylmethyl)sulfonyl-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-2-(phenylmethyl)sulfonyl-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-benzylsulfonyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)acetamide CAS Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-2-(phenylmethyl)sulfonyl-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-benzylsulfonyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-benzylsulfonyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)acetamide Formula: C23H20ClN3O4S2 MolecularWeight: 502.0056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CN=CC=C3)C(=O)CS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

COC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CN=CC=C3)C(=O)CS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H20ClN3O4S2/c1-31-19-10-9-18(24)22-21(19)26-23(32-22)27(13-17-8-5-11-25-12-17)20(28)15-33(29,30)14-16-6-3-2-4-7-16/h2-12H,13-15H2,1H3