4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)butanamide

Systemtic Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)butanamide Openeye Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)butanamide CAS Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]butanamide IUPAC Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)butanamide Traditional Name: 4-[1,3-benzodioxol-5-yl(mesyl)amino]-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)butyramide Formula: C23H29N3O8S2 MolecularWeight: 539.62166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)CCCN(C3=CC4=C(C=C3)OCO4)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)CCCN(C3=CC4=C(C=C3)OCO4)S(=O)(=O)C

InChI

InChI=1S/C23H29N3O8S2/c1-32-20-10-8-18(36(30,31)25-11-3-4-12-25)15-19(20)24-23(27)6-5-13-26(35(2,28)29)17-7-9-21-22(14-17)34-16-33-21/h7-10,14-15H,3-6,11-13,16H2,1-2H3,(H,24,27)