ethyl (E)-3-fluoranyl-4-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-4-sulfanylidene-but-2-enoate

Systemtic Name: ethyl (E)-3-fluoranyl-4-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-4-sulfanylidene-but-2-enoate Openeye Name: ethyl (E)-4-[(1-benzyl-2-methoxy-2-oxo-ethyl)amino]-3-fluoro-4-thioxo-but-2-enoate CAS Name: (E)-3-fluoro-4-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-4-sulfanylidene-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-fluoro-4-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-4-sulfanylidenebut-2-enoate Traditional Name: (E)-4-[(1-benzyl-2-keto-2-methoxy-ethyl)amino]-3-fluoro-4-thioxo-but-2-enoic acid ethyl ester Formula: C16H18FNO4S MolecularWeight: 339.381823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C(=S)NC(CC1=CC=CC=C1)C(=O)OC)F

Isomeric SMILES

CCOC(=O)/C=C(\C(=S)NC(CC1=CC=CC=C1)C(=O)OC)/F

InChI

InChI=1S/C16H18FNO4S/c1-3-22-14(19)10-12(17)15(23)18-13(16(20)21-2)9-11-7-5-4-6-8-11/h4-8,10,13H,3,9H2,1-2H3,(H,18,23)/b12-10+