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

Systemtic Name: N'-(3-chloranyl-2-methyl-phenyl)-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]ethanediamide Openeye Name: N'-(3-chloro-2-methyl-phenyl)-N-[2-(4-methylpiperazin-1-yl)-2-(3-thienyl)ethyl]oxamide CAS Name: N'-(3-chloro-2-methylphenyl)-N-[2-(4-methyl-1-piperazinyl)-2-(3-thiophenyl)ethyl]oxamide IUPAC Name: N'-(3-chloro-2-methylphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-ylethyl]oxamide Traditional Name: N'-(3-chloro-2-methyl-phenyl)-N-[2-(4-methylpiperazino)-2-(3-thienyl)ethyl]oxamide Formula: C20H25ClN4O2S MolecularWeight: 420.9561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(=O)NCC(C2=CSC=C2)N3CCN(CC3)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C(=O)NCC(C2=CSC=C2)N3CCN(CC3)C

InChI

InChI=1S/C20H25ClN4O2S/c1-14-16(21)4-3-5-17(14)23-20(27)19(26)22-12-18(15-6-11-28-13-15)25-9-7-24(2)8-10-25/h3-6,11,13,18H,7-10,12H2,1-2H3,(H,22,26)(H,23,27)