(E)-3-(5-phenylthiophen-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(5-phenylthiophen-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(5-phenyl-2-thienyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-3-(5-phenyl-2-thiophenyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(5-phenylthiophen-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(5-phenyl-2-thienyl)-1-[4-(2-pyrimidyl)piperazino]prop-2-en-1-one Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C=CC3=CC=C(S3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)/C=C/C3=CC=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4OS/c26-20(24-13-15-25(16-14-24)21-22-11-4-12-23-21)10-8-18-7-9-19(27-18)17-5-2-1-3-6-17/h1-12H,13-16H2/b10-8+