N-[(2,4-dimethylphenyl)methyl]-4-fluoranyl-N-methyl-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[(2,4-dimethylphenyl)methyl]-4-fluoranyl-N-methyl-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[(2,4-dimethylphenyl)methyl]-4-fluoro-N-methyl-3-morpholinosulfonyl-benzamide CAS Name: N-[(2,4-dimethylphenyl)methyl]-4-fluoro-N-methyl-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(2,4-dimethylphenyl)methyl]-4-fluoro-N-methyl-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(2,4-dimethylbenzyl)-4-fluoro-N-methyl-3-morpholinosulfonyl-benzamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN(C)C(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN(C)C(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C21H25FN2O4S/c1-15-4-5-18(16(2)12-15)14-23(3)21(25)17-6-7-19(22)20(13-17)29(26,27)24-8-10-28-11-9-24/h4-7,12-13H,8-11,14H2,1-3H3