(E)-3-phenyl-N-[6-(4-thiophen-2-ylcarbonylpiperazin-1-yl)pyridin-3-yl]prop-2-enamide

Systemtic Name: (E)-3-phenyl-N-[6-(4-thiophen-2-ylcarbonylpiperazin-1-yl)pyridin-3-yl]prop-2-enamide Openeye Name: (E)-3-phenyl-N-[6-[4-(thiophene-2-carbonyl)piperazin-1-yl]-3-pyridyl]prop-2-enamide CAS Name: (E)-N-[6-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-pyridinyl]-3-phenyl-2-propenamide IUPAC Name: (E)-3-phenyl-N-[6-[4-(thiophene-2-carbonyl)piperazin-1-yl]pyridin-3-yl]prop-2-enamide Traditional Name: (E)-3-phenyl-N-[6-[4-(2-thenoyl)piperazino]-3-pyridyl]acrylamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)NC(=O)C=CC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)NC(=O)/C=C/C3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C23H22N4O2S/c28-22(11-8-18-5-2-1-3-6-18)25-19-9-10-21(24-17-19)26-12-14-27(15-13-26)23(29)20-7-4-16-30-20/h1-11,16-17H,12-15H2,(H,25,28)/b11-8+