4-[(E)-3-[3-(2-hydroxyethyl)-4-(thiophen-3-ylmethyl)piperazin-1-yl]prop-1-enyl]-2-methoxy-phenol

Systemtic Name: 4-[(E)-3-[3-(2-hydroxyethyl)-4-(thiophen-3-ylmethyl)piperazin-1-yl]prop-1-enyl]-2-methoxy-phenol Openeye Name: 4-[(E)-3-[3-(2-hydroxyethyl)-4-(3-thienylmethyl)piperazin-1-yl]prop-1-enyl]-2-methoxy-phenol CAS Name: 4-[(E)-3-[3-(2-hydroxyethyl)-4-(3-thiophenylmethyl)-1-piperazinyl]prop-1-enyl]-2-methoxyphenol IUPAC Name: 4-[(E)-3-[3-(2-hydroxyethyl)-4-(thiophen-3-ylmethyl)piperazin-1-yl]prop-1-enyl]-2-methoxyphenol Traditional Name: 4-[(E)-3-[3-(2-hydroxyethyl)-4-(3-thenyl)piperazino]prop-1-enyl]-2-methoxy-phenol Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CCN2CCN(C(C2)CCO)CC3=CSC=C3)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/CN2CCN(C(C2)CCO)CC3=CSC=C3)O

InChI

InChI=1S/C21H28N2O3S/c1-26-21-13-17(4-5-20(21)25)3-2-8-22-9-10-23(19(15-22)6-11-24)14-18-7-12-27-16-18/h2-5,7,12-13,16,19,24-25H,6,8-11,14-15H2,1H3/b3-2+