4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(4-morpholin-4-ylsulfonylphenyl)butanamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(4-morpholin-4-ylsulfonylphenyl)butanamide Openeye Name: 4-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-(4-morpholinosulfonylphenyl)butanamide CAS Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[4-(4-morpholinylsulfonyl)phenyl]butanamide IUPAC Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-(4-morpholin-4-ylsulfonylphenyl)butanamide Traditional Name: 4-(3-chloro-N-mesyl-4-methoxy-anilino)-N-(4-morpholinosulfonylphenyl)butyramide Formula: C22H28ClN3O7S2 MolecularWeight: 546.05662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)S(=O)(=O)C)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N(CCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)S(=O)(=O)C)Cl

InChI

InChI=1S/C22H28ClN3O7S2/c1-32-21-10-7-18(16-20(21)23)26(34(2,28)29)11-3-4-22(27)24-17-5-8-19(9-6-17)35(30,31)25-12-14-33-15-13-25/h5-10,16H,3-4,11-15H2,1-2H3,(H,24,27)