[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] (E)-3-thiophen-2-ylprop-2-enoate

Systemtic Name: [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] (E)-3-thiophen-2-ylprop-2-enoate Openeye Name: [2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl] (E)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] (E)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-(2-thienyl)acrylic acid [2-[bis(2-cyanoethyl)amino]-2-keto-ethyl] ester Formula: C15H15N3O3S MolecularWeight: 317.3629

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=CC(=O)OCC(=O)N(CCC#N)CCC#N

Isomeric SMILES

C1=CSC(=C1)/C=C/C(=O)OCC(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C15H15N3O3S/c16-7-2-9-18(10-3-8-17)14(19)12-21-15(20)6-5-13-4-1-11-22-13/h1,4-6,11H,2-3,9-10,12H2/b6-5+