2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]-1-(4-propan-2-ylthiophen-2-yl)propan-1-one hydrochloride

Systemtic Name: 2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]-1-(4-propan-2-ylthiophen-2-yl)propan-1-one hydrochloride Openeye Name: 1-(4-isopropyl-2-thienyl)-2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]propan-1-one hydrochloride CAS Name: 2-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]-1-(4-propan-2-yl-2-thiophenyl)-1-propanone hydrochloride IUPAC Name: 2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]-1-(4-propan-2-ylthiophen-2-yl)propan-1-one hydrochloride Traditional Name: 1-(4-isopropyl-2-thienyl)-2-[4-[(E)-3-phenylacryloyl]piperazino]propan-1-one hydrochloride Formula: C23H29ClN2O2S MolecularWeight: 433.00656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CSC(=C1)C(=O)C(C)N2CCN(CC2)C(=O)C=CC3=CC=CC=C3.Cl

Isomeric SMILES

CC(C)C1=CSC(=C1)C(=O)C(C)N2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3.Cl

InChI

InChI=1S/C23H28N2O2S.ClH/c1-17(2)20-15-21(28-16-20)23(27)18(3)24-11-13-25(14-12-24)22(26)10-9-19-7-5-4-6-8-19;/h4-10,15-18H,11-14H2,1-3H3;1H/b10-9+;