ethyl (Z)-2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonyl]-3-(cyclopropylamino)prop-2-enoate

Systemtic Name: ethyl (Z)-2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonyl]-3-(cyclopropylamino)prop-2-enoate Openeye Name: ethyl (Z)-2-(3-chloro-6-fluoro-benzothiophene-2-carbonyl)-3-(cyclopropylamino)prop-2-enoate CAS Name: (Z)-2-[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]-3-(cyclopropylamino)-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)-3-(cyclopropylamino)prop-2-enoate Traditional Name: (Z)-2-(3-chloro-6-fluoro-benzothiophene-2-carbonyl)-3-(cyclopropylamino)acrylic acid ethyl ester Formula: C17H15ClFNO3S MolecularWeight: 367.822303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1CC1)C(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

Isomeric SMILES

CCOC(=O)/C(=C\NC1CC1)/C(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

InChI

InChI=1S/C17H15ClFNO3S/c1-2-23-17(22)12(8-20-10-4-5-10)15(21)16-14(18)11-6-3-9(19)7-13(11)24-16/h3,6-8,10,20H,2,4-5H2,1H3/b12-8-