4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[(2,3,4-trimethoxyphenyl)methyl]butanamide

Systemtic Name: 4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[(2,3,4-trimethoxyphenyl)methyl]butanamide Openeye Name: 4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[(2,3,4-trimethoxyphenyl)methyl]butanamide CAS Name: 4-[(4-fluorophenyl)sulfonyl-methylamino]-N-[(2,3,4-trimethoxyphenyl)methyl]butanamide IUPAC Name: 4-[(4-fluorophenyl)sulfonyl-methylamino]-N-[(2,3,4-trimethoxyphenyl)methyl]butanamide Traditional Name: 4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-(2,3,4-trimethoxybenzyl)butyramide Formula: C21H27FN2O6S MolecularWeight: 454.512283

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)NCC1=C(C(=C(C=C1)OC)OC)OC)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CN(CCCC(=O)NCC1=C(C(=C(C=C1)OC)OC)OC)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C21H27FN2O6S/c1-24(31(26,27)17-10-8-16(22)9-11-17)13-5-6-19(25)23-14-15-7-12-18(28-2)21(30-4)20(15)29-3/h7-12H,5-6,13-14H2,1-4H3,(H,23,25)