(E)-3-thiophen-2-yl-1-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-thiophen-2-yl-1-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(2-thienyl)-1-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-thiophen-2-yl-1-[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-thiophen-2-yl-1-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(2-thienyl)-1-[4-(2,3,4-trimethoxybenzyl)piperazino]prop-2-en-1-one Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)C=CC3=CC=CS3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)/C=C/C3=CC=CS3)OC)OC

InChI

InChI=1S/C21H26N2O4S/c1-25-18-8-6-16(20(26-2)21(18)27-3)15-22-10-12-23(13-11-22)19(24)9-7-17-5-4-14-28-17/h4-9,14H,10-13,15H2,1-3H3/b9-7+