(E)-N-(2-methoxyethyl)-3-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-N-(2-methoxyethyl)-3-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]-N-(2-methoxyethyl)prop-2-enamide CAS Name: (E)-N-(2-methoxyethyl)-3-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-3-(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)-N-(2-methoxyethyl)prop-2-enamide Traditional Name: (E)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]-N-(2-methoxyethyl)acrylamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C=CC1=CN(N=C1C2=CC=CS2)CC3=CC=CC=C3

Isomeric SMILES

COCCNC(=O)/C=C/C1=CN(N=C1C2=CC=CS2)CC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2S/c1-25-12-11-21-19(24)10-9-17-15-23(14-16-6-3-2-4-7-16)22-20(17)18-8-5-13-26-18/h2-10,13,15H,11-12,14H2,1H3,(H,21,24)/b10-9+