N-[(Z)-1-(3-fluoranyl-4-methoxy-phenyl)ethylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(Z)-1-(3-fluoranyl-4-methoxy-phenyl)ethylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(Z)-1-(3-fluoro-4-methoxy-phenyl)ethylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(Z)-1-(3-fluoro-4-methoxyphenyl)ethylideneamino]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(Z)-1-(3-fluoro-4-methoxyphenyl)ethylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(Z)-1-(3-fluoro-4-methoxy-phenyl)ethylideneamino]-3-pyrrolidinosulfonyl-benzamide Formula: C20H22FN3O4S MolecularWeight: 419.469783

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

C/C(=N/NC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)/C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C20H22FN3O4S/c1-14(15-8-9-19(28-2)18(21)13-15)22-23-20(25)16-6-5-7-17(12-16)29(26,27)24-10-3-4-11-24/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,23,25)/b22-14-