2-(4-chloranyl-3-methyl-phenoxy)-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]ethanamide

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-yl-ethyl]ethanamide Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-N-[2-(4-methylpiperazin-1-yl)-2-(3-thienyl)ethyl]acetamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-[2-(4-methyl-1-piperazinyl)-2-(3-thiophenyl)ethyl]acetamide IUPAC Name: 2-(4-chloro-3-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-ylethyl]acetamide Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-N-[2-(4-methylpiperazino)-2-(3-thienyl)ethyl]acetamide Formula: C20H26ClN3O2S MolecularWeight: 407.95734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26ClN3O2S/c1-15-11-17(3-4-18(15)21)26-13-20(25)22-12-19(16-5-10-27-14-16)24-8-6-23(2)7-9-24/h3-5,10-11,14,19H,6-9,12-13H2,1-2H3,(H,22,25)