N-(2-methylprop-2-enyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide

Systemtic Name: N-(2-methylprop-2-enyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Openeye Name: N-(2-methylallyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide CAS Name: N-(2-methylprop-2-enyl)-4-(4-nitrophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-methylprop-2-enyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Traditional Name: N-(2-methylallyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Formula: C15H20N4O2S MolecularWeight: 320.4099

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N4O2S/c1-12(2)11-16-15(22)18-9-7-17(8-10-18)13-3-5-14(6-4-13)19(20)21/h3-6H,1,7-11H2,2H3,(H,16,22)