(E)-N-[(4-but-2-ynoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[(4-but-2-ynoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[(4-but-2-ynoxyphenyl)methyl]-N-(3-pyridylmethyl)-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[(4-but-2-ynoxyphenyl)methyl]-N-(3-pyridinylmethyl)-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[(4-but-2-ynoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-(4-but-2-ynoxybenzyl)-N-(3-pyridylmethyl)-3-(2-thienyl)acrylamide Formula: C24H22N2O2S MolecularWeight: 402.50868

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=O)C=CC3=CC=CS3

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C24H22N2O2S/c1-2-3-15-28-22-10-8-20(9-11-22)18-26(19-21-6-4-14-25-17-21)24(27)13-12-23-7-5-16-29-23/h4-14,16-17H,15,18-19H2,1H3/b13-12+