3,4-diethoxy-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]benzamide

Systemtic Name: 3,4-diethoxy-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]benzamide Openeye Name: 3,4-diethoxy-N-[2-(4-methylpiperazin-1-yl)-2-(3-thienyl)ethyl]benzamide CAS Name: 3,4-diethoxy-N-[2-(4-methyl-1-piperazinyl)-2-(3-thiophenyl)ethyl]benzamide IUPAC Name: 3,4-diethoxy-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-ylethyl]benzamide Traditional Name: 3,4-diethoxy-N-[2-(4-methylpiperazino)-2-(3-thienyl)ethyl]benzamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC(C2=CSC=C2)N3CCN(CC3)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC(C2=CSC=C2)N3CCN(CC3)C)OCC

InChI

InChI=1S/C22H31N3O3S/c1-4-27-20-7-6-17(14-21(20)28-5-2)22(26)23-15-19(18-8-13-29-16-18)25-11-9-24(3)10-12-25/h6-8,13-14,16,19H,4-5,9-12,15H2,1-3H3,(H,23,26)