[(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: [(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: [(1S)-1-methyl-2-oxo-2-ureido-ethyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid [(2S)-1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(carbamoylamino)-1-oxopropan-2-yl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid [(1S)-2-keto-1-methyl-2-ureido-ethyl] ester Formula: C14H13N3O4S MolecularWeight: 319.33572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)OC(=O)C=CC1=NC2=CC=CC=C2S1

Isomeric SMILES

C[C@@H](C(=O)NC(=O)N)OC(=O)/C=C/C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H13N3O4S/c1-8(13(19)17-14(15)20)21-12(18)7-6-11-16-9-4-2-3-5-10(9)22-11/h2-8H,1H3,(H3,15,17,19,20)/b7-6+/t8-/m0/s1