(2-phenyl-1,3-thiazol-4-yl)methyl (E)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl (E)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate Openeye Name: (2-phenylthiazol-4-yl)methyl (E)-3-(1-benzylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-[1-(phenylmethyl)-4-pyrazolyl]-2-propenoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl (E)-3-(1-benzylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1-benzylpyrazol-4-yl)acrylic acid (2-phenylthiazol-4-yl)methyl ester Formula: C23H19N3O2S MolecularWeight: 401.48086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C=CC(=O)OCC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)/C=C/C(=O)OCC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C23H19N3O2S/c27-22(28-16-21-17-29-23(25-21)20-9-5-2-6-10-20)12-11-19-13-24-26(15-19)14-18-7-3-1-4-8-18/h1-13,15,17H,14,16H2/b12-11+