2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-[2-methyl-4-(4-methylpiperazino)phenyl]acetamide Formula: C22H28N6OS2 MolecularWeight: 456.62732

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)N3CCN(CC3)C)C)C4=CC=CS4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)N3CCN(CC3)C)C)C4=CC=CS4

InChI

InChI=1S/C22H28N6OS2/c1-4-28-21(19-6-5-13-30-19)24-25-22(28)31-15-20(29)23-18-8-7-17(14-16(18)2)27-11-9-26(3)10-12-27/h5-8,13-14H,4,9-12,15H2,1-3H3,(H,23,29)