N-[3-[(4-ethoxyphenyl)-[4-(phenylmethyl)piperazin-1-yl]methyl]-5-ethyl-thiophen-2-yl]benzamide

Systemtic Name: N-[3-[(4-ethoxyphenyl)-[4-(phenylmethyl)piperazin-1-yl]methyl]-5-ethyl-thiophen-2-yl]benzamide Openeye Name: N-[3-[(4-benzylpiperazin-1-yl)-(4-ethoxyphenyl)methyl]-5-ethyl-2-thienyl]benzamide CAS Name: N-[3-[(4-ethoxyphenyl)-[4-(phenylmethyl)-1-piperazinyl]methyl]-5-ethyl-2-thiophenyl]benzamide IUPAC Name: N-[3-[(4-benzylpiperazin-1-yl)-(4-ethoxyphenyl)methyl]-5-ethylthiophen-2-yl]benzamide Traditional Name: N-[3-[(4-benzylpiperazino)-p-phenetyl-methyl]-5-ethyl-2-thienyl]benzamide Formula: C33H37N3O2S MolecularWeight: 539.73078

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C(C3=CC=C(C=C3)OCC)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C(C3=CC=C(C=C3)OCC)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C33H37N3O2S/c1-3-29-23-30(33(39-29)34-32(37)27-13-9-6-10-14-27)31(26-15-17-28(18-16-26)38-4-2)36-21-19-35(20-22-36)24-25-11-7-5-8-12-25/h5-18,23,31H,3-4,19-22,24H2,1-2H3,(H,34,37)