2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide

Systemtic Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide Openeye Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(mesyl)amino]-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)propionamide Formula: C23H29N3O8S2 MolecularWeight: 539.62166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OC)N(C3=CC4=C(C=C3)OCCO4)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OC)N(C3=CC4=C(C=C3)OCCO4)S(=O)(=O)C

InChI

InChI=1S/C23H29N3O8S2/c1-16(26(35(3,28)29)17-6-8-21-22(14-17)34-13-12-33-21)23(27)24-19-15-18(7-9-20(19)32-2)36(30,31)25-10-4-5-11-25/h6-9,14-16H,4-5,10-13H2,1-3H3,(H,24,27)