N,N-diethyl-4-[(3-hydroxyphenyl)-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N,N-diethyl-4-[(3-hydroxyphenyl)-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]benzamide Openeye Name: N,N-diethyl-4-[(3-hydroxyphenyl)-[4-(3-thienylmethyl)piperazin-1-yl]methyl]benzamide CAS Name: N,N-diethyl-4-[(3-hydroxyphenyl)-[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]benzamide IUPAC Name: N,N-diethyl-4-[(3-hydroxyphenyl)-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]benzamide Traditional Name: N,N-diethyl-4-[(3-hydroxyphenyl)-[4-(3-thenyl)piperazino]methyl]benzamide Formula: C27H33N3O2S MolecularWeight: 463.63482

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC(=CC=C2)O)N3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC(=CC=C2)O)N3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C27H33N3O2S/c1-3-29(4-2)27(32)23-10-8-22(9-11-23)26(24-6-5-7-25(31)18-24)30-15-13-28(14-16-30)19-21-12-17-33-20-21/h5-12,17-18,20,26,31H,3-4,13-16,19H2,1-2H3