[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (E)-3-(5-bromanylthiophen-2-yl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (E)-3-(5-bromanylthiophen-2-yl)prop-2-enoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (E)-3-(5-bromo-2-thienyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-thiophenyl)-2-propenoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (E)-3-(5-bromothiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-thienyl)acrylic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C12H10BrNO3S MolecularWeight: 328.1817

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C=CC1=CC=C(S1)Br

Isomeric SMILES

C#CCNC(=O)COC(=O)/C=C/C1=CC=C(S1)Br

InChI

InChI=1S/C12H10BrNO3S/c1-2-7-14-11(15)8-17-12(16)6-4-9-3-5-10(13)18-9/h1,3-6H,7-8H2,(H,14,15)/b6-4+