2-[(5-methylthiophen-2-yl)methyl-phenethyl-amino]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(5-methylthiophen-2-yl)methyl-phenethyl-amino]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone Openeye Name: 2-[(5-methyl-2-thienyl)methyl-phenethyl-amino]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-[(5-methyl-2-thiophenyl)methyl-phenethylamino]-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-[(5-methylthiophen-2-yl)methyl-phenethylamino]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-[(5-methyl-2-thienyl)methyl-phenethyl-amino]-1-[4-(2-thenoyl)piperazino]ethanone Formula: C25H29N3O2S2 MolecularWeight: 467.64666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)CC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)CC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H29N3O2S2/c1-20-9-10-22(32-20)18-26(12-11-21-6-3-2-4-7-21)19-24(29)27-13-15-28(16-14-27)25(30)23-8-5-17-31-23/h2-10,17H,11-16,18-19H2,1H3