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

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-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 [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC(=O)C=CC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[C@H](C(=O)NC1CC1)OC(=O)/C=C/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H16N2O3S/c1-10(16(20)17-11-6-7-11)21-15(19)9-8-14-18-12-4-2-3-5-13(12)22-14/h2-5,8-11H,6-7H2,1H3,(H,17,20)/b9-8+/t10-/m1/s1