N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-4-[methylsulfonyl(prop-2-enyl)amino]benzamide

Systemtic Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-4-[methylsulfonyl(prop-2-enyl)amino]benzamide Openeye Name: 4-[allyl(methylsulfonyl)amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide CAS Name: N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]-4-[methylsulfonyl(prop-2-enyl)amino]benzamide IUPAC Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)-4-[methylsulfonyl(prop-2-enyl)amino]benzamide Traditional Name: 4-[allyl(mesyl)amino]-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)benzamide Formula: C22H27N3O6S2 MolecularWeight: 493.59628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)C3=CC=C(C=C3)N(CC=C)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)C3=CC=C(C=C3)N(CC=C)S(=O)(=O)C

InChI

InChI=1S/C22H27N3O6S2/c1-4-13-25(32(3,27)28)18-9-7-17(8-10-18)22(26)23-20-16-19(11-12-21(20)31-2)33(29,30)24-14-5-6-15-24/h4,7-12,16H,1,5-6,13-15H2,2-3H3,(H,23,26)