4-(4-nitrophenyl)-N-propan-2-yl-piperazine-1-carbothioamide

Systemtic Name: 4-(4-nitrophenyl)-N-propan-2-yl-piperazine-1-carbothioamide Openeye Name: N-isopropyl-4-(4-nitrophenyl)piperazine-1-carbothioamide CAS Name: 4-(4-nitrophenyl)-N-propan-2-yl-1-piperazinecarbothioamide IUPAC Name: 4-(4-nitrophenyl)-N-propan-2-ylpiperazine-1-carbothioamide Traditional Name: N-isopropyl-4-(4-nitrophenyl)piperazine-1-carbothioamide Formula: C14H20N4O2S MolecularWeight: 308.3992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N4O2S/c1-11(2)15-14(21)17-9-7-16(8-10-17)12-3-5-13(6-4-12)18(19)20/h3-6,11H,7-10H2,1-2H3,(H,15,21)