[(1R)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: [(1R)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: [(1R)-2-morpholino-2-oxo-1-phenyl-ethyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid [(1R)-2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid [(1R)-2-keto-2-morpholino-1-phenyl-ethyl] ester Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(C2=CC=CC=C2)OC(=O)C=CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1C(=O)[C@@H](C2=CC=CC=C2)OC(=O)/C=C/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H20N2O4S/c25-20(11-10-19-23-17-8-4-5-9-18(17)29-19)28-21(16-6-2-1-3-7-16)22(26)24-12-14-27-15-13-24/h1-11,21H,12-15H2/b11-10+/t21-/m1/s1