4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(4-piperidin-1-ylsulfonylphenyl)butanamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(4-piperidin-1-ylsulfonylphenyl)butanamide Openeye Name: 4-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-[4-(1-piperidylsulfonyl)phenyl]butanamide CAS Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[4-(1-piperidinylsulfonyl)phenyl]butanamide IUPAC Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-(4-piperidin-1-ylsulfonylphenyl)butanamide Traditional Name: 4-(3-chloro-N-mesyl-4-methoxy-anilino)-N-(4-piperidinosulfonylphenyl)butyramide Formula: C23H30ClN3O6S2 MolecularWeight: 544.0838

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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)N3CCCCC3)S(=O)(=O)C)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N(CCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)S(=O)(=O)C)Cl

InChI

InChI=1S/C23H30ClN3O6S2/c1-33-22-13-10-19(17-21(22)24)27(34(2,29)30)16-6-7-23(28)25-18-8-11-20(12-9-18)35(31,32)26-14-4-3-5-15-26/h8-13,17H,3-7,14-16H2,1-2H3,(H,25,28)