N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-ethyl-N-[(3-fluoro-4-methoxy-phenyl)methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-ethyl-N-(3-fluoro-4-methoxy-benzyl)-3-pyrrolidinosulfonyl-benzamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H25FN2O4S/c1-3-23(15-16-9-10-20(28-2)19(22)13-16)21(25)17-7-6-8-18(14-17)29(26,27)24-11-4-5-12-24/h6-10,13-14H,3-5,11-12,15H2,1-2H3