2-methyl-N-[4-(4-nitrophenyl)piperazin-1-yl]carbothioyl-propanamide

Systemtic Name: 2-methyl-N-[4-(4-nitrophenyl)piperazin-1-yl]carbothioyl-propanamide Openeye Name: 2-methyl-N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]propanamide CAS Name: 2-methyl-N-[[4-(4-nitrophenyl)-1-piperazinyl]-sulfanylidenemethyl]propanamide IUPAC Name: 2-methyl-N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]propanamide Traditional Name: 2-methyl-N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]propionamide Formula: C15H20N4O3S MolecularWeight: 336.4093

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)NC(=S)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H20N4O3S/c1-11(2)14(20)16-15(23)18-9-7-17(8-10-18)12-3-5-13(6-4-12)19(21)22/h3-6,11H,7-10H2,1-2H3,(H,16,20,23)