3-(2-chlorophenyl)-N-(4-ethanoylpiperazin-1-yl)carbothioyl-5-methyl-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chlorophenyl)-N-(4-ethanoylpiperazin-1-yl)carbothioyl-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: N-(4-acetylpiperazine-1-carbothioyl)-3-(2-chlorophenyl)-5-methyl-isoxazole-4-carboxamide CAS Name: N-[(4-acetyl-1-piperazinyl)-sulfanylidenemethyl]-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide IUPAC Name: N-(4-acetylpiperazine-1-carbothioyl)-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: N-(4-acetylpiperazine-1-carbothioyl)-3-(2-chlorophenyl)-5-methyl-isoxazole-4-carboxamide Formula: C18H19ClN4O3S MolecularWeight: 406.88646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)N3CCN(CC3)C(=O)C

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C18H19ClN4O3S/c1-11-15(16(21-26-11)13-5-3-4-6-14(13)19)17(25)20-18(27)23-9-7-22(8-10-23)12(2)24/h3-6H,7-10H2,1-2H3,(H,20,25,27)