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

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl (E)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl (E)-3-(1-benzylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-[1-(phenylmethyl)-4-pyrazolyl]-2-propenoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-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-(3-thienyl)thiazol-4-yl]methyl ester Formula: C21H17N3O2S2 MolecularWeight: 407.50858

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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=CSC=C4

Isomeric SMILES

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

InChI

InChI=1S/C21H17N3O2S2/c25-20(26-13-19-15-28-21(23-19)18-8-9-27-14-18)7-6-17-10-22-24(12-17)11-16-4-2-1-3-5-16/h1-10,12,14-15H,11,13H2/b7-6+