N'-(3-methylphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]ethanediamide

Systemtic Name: N'-(3-methylphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]ethanediamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)-2-(3-thienyl)ethyl]-N'-(m-tolyl)oxamide CAS Name: N'-(3-methylphenyl)-N-[2-(4-methyl-1-piperazinyl)-2-(3-thiophenyl)ethyl]oxamide IUPAC Name: N'-(3-methylphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-ylethyl]oxamide Traditional Name: N-[2-(4-methylpiperazino)-2-(3-thienyl)ethyl]-N'-(m-tolyl)oxamide Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(=O)NCC(C2=CSC=C2)N3CCN(CC3)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C(=O)NCC(C2=CSC=C2)N3CCN(CC3)C

InChI

InChI=1S/C20H26N4O2S/c1-15-4-3-5-17(12-15)22-20(26)19(25)21-13-18(16-6-11-27-14-16)24-9-7-23(2)8-10-24/h3-6,11-12,14,18H,7-10,13H2,1-2H3,(H,21,25)(H,22,26)