S-(2-acetamidonaphthalen-1-yl) (E)-4-[(7-fluoranyl-9H-fluoren-2-yl)amino]-4-oxidanylidene-but-2-enethioate

Systemtic Name: S-(2-acetamidonaphthalen-1-yl) (E)-4-[(7-fluoranyl-9H-fluoren-2-yl)amino]-4-oxidanylidene-but-2-enethioate Openeye Name: S-(2-acetamido-1-naphthyl) (E)-4-[(7-fluoro-9H-fluoren-2-yl)amino]-4-oxo-but-2-enethioate CAS Name: (E)-4-[(7-fluoro-9H-fluoren-2-yl)amino]-4-oxo-2-butenethioic acid S-(2-acetamido-1-naphthalenyl) ester IUPAC Name: S-(2-acetamidonaphthalen-1-yl) (E)-4-[(7-fluoro-9H-fluoren-2-yl)amino]-4-oxobut-2-enethioate Traditional Name: (E)-4-[(7-fluoro-9H-fluoren-2-yl)amino]-4-keto-but-2-enethioic acid S-(2-acetamido-1-naphthyl) ester Formula: C29H21FN2O3S MolecularWeight: 496.552043

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=CC=CC=C2C=C1)SC(=O)C=CC(=O)NC3=CC4=C(C=C3)C5=C(C4)C=C(C=C5)F

Isomeric SMILES

CC(=O)NC1=C(C2=CC=CC=C2C=C1)SC(=O)/C=C/C(=O)NC3=CC4=C(C=C3)C5=C(C4)C=C(C=C5)F

InChI

InChI=1S/C29H21FN2O3S/c1-17(33)31-26-11-6-18-4-2-3-5-25(18)29(26)36-28(35)13-12-27(34)32-22-8-10-24-20(16-22)14-19-15-21(30)7-9-23(19)24/h2-13,15-16H,14H2,1H3,(H,31,33)(H,32,34)/b13-12+