ethyl (E)-3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]but-2-enoate

Systemtic Name: ethyl (E)-3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]but-2-enoate Openeye Name: ethyl (E)-3-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]but-2-enoate CAS Name: (E)-3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]but-2-enoate Traditional Name: (E)-3-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]but-2-enoic acid ethyl ester Formula: C15H18N2O2S MolecularWeight: 290.38062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC1=C(C2=C(S1)CCCC2)C#N

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC1=C(C2=C(S1)CCCC2)C#N

InChI

InChI=1S/C15H18N2O2S/c1-3-19-14(18)8-10(2)17-15-12(9-16)11-6-4-5-7-13(11)20-15/h8,17H,3-7H2,1-2H3/b10-8+