(E)-3-(1-methylpyrazol-4-yl)-1-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(1-methylpyrazol-4-yl)-1-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(1-methylpyrazol-4-yl)-1-[4-[(5-phenyl-2-thienyl)methyl]piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(1-methyl-4-pyrazolyl)-1-[4-[(5-phenyl-2-thiophenyl)methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(1-methylpyrazol-4-yl)-1-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(1-methylpyrazol-4-yl)-1-[4-[(5-phenyl-2-thienyl)methyl]piperazino]prop-2-en-1-one Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C=CC(=O)N2CCN(CC2)CC3=CC=C(S3)C4=CC=CC=C4

Isomeric SMILES

CN1C=C(C=N1)/C=C/C(=O)N2CCN(CC2)CC3=CC=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4OS/c1-24-16-18(15-23-24)7-10-22(27)26-13-11-25(12-14-26)17-20-8-9-21(28-20)19-5-3-2-4-6-19/h2-10,15-16H,11-14,17H2,1H3/b10-7+