N-[5-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-4-methyl-thiophen-2-yl]-2,2-dimethyl-propanamide

Systemtic Name: N-[5-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-4-methyl-thiophen-2-yl]-2,2-dimethyl-propanamide Openeye Name: N-[5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-4-methyl-2-thienyl]-2,2-dimethyl-propanamide CAS Name: N-[5-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-4-methyl-2-thiophenyl]-2,2-dimethylpropanamide IUPAC Name: N-[5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-4-methylthiophen-2-yl]-2,2-dimethylpropanamide Traditional Name: N-[5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-4-methyl-2-thienyl]-2,2-dimethyl-propionamide Formula: C21H26ClN3O2S MolecularWeight: 419.96804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C(C)(C)C)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C(C)(C)C)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H26ClN3O2S/c1-14-12-17(23-20(27)21(2,3)4)28-18(14)19(26)25-10-8-24(9-11-25)16-7-5-6-15(22)13-16/h5-7,12-13H,8-11H2,1-4H3,(H,23,27)