ethyl (E)-3-(3-acetyloxypropylsulfanyl)-3-azanyl-2-(pentanoylamino)prop-2-enoate

Systemtic Name: ethyl (E)-3-(3-acetyloxypropylsulfanyl)-3-azanyl-2-(pentanoylamino)prop-2-enoate Openeye Name: ethyl (E)-3-(3-acetoxypropylsulfanyl)-3-amino-2-(pentanoylamino)prop-2-enoate CAS Name: (E)-3-(3-acetyloxypropylthio)-3-amino-2-(1-oxopentylamino)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(3-acetyloxypropylsulfanyl)-3-amino-2-(pentanoylamino)prop-2-enoate Traditional Name: (E)-3-(3-acetoxypropylthio)-3-amino-2-(valerylamino)acrylic acid ethyl ester Formula: C15H26N2O5S MolecularWeight: 346.44234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=C(N)SCCCOC(=O)C)C(=O)OCC

Isomeric SMILES

CCCCC(=O)N/C(=C(\N)/SCCCOC(=O)C)/C(=O)OCC

InChI

InChI=1S/C15H26N2O5S/c1-4-6-8-12(19)17-13(15(20)21-5-2)14(16)23-10-7-9-22-11(3)18/h4-10,16H2,1-3H3,(H,17,19)/b14-13+