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

Systemtic Name: 2,2-dimethyl-N-[4-(4-nitrophenyl)piperazin-1-yl]carbothioyl-propanamide Openeye Name: 2,2-dimethyl-N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]propanamide CAS Name: 2,2-dimethyl-N-[[4-(4-nitrophenyl)-1-piperazinyl]-sulfanylidenemethyl]propanamide IUPAC Name: 2,2-dimethyl-N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]propanamide Traditional Name: 2,2-dimethyl-N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]propionamide Formula: C16H22N4O3S MolecularWeight: 350.43588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4O3S/c1-16(2,3)14(21)17-15(24)19-10-8-18(9-11-19)12-4-6-13(7-5-12)20(22)23/h4-7H,8-11H2,1-3H3,(H,17,21,24)