N-(3-nitrophenyl)-4-propyl-piperazine-1-carbothioamide

Systemtic Name: N-(3-nitrophenyl)-4-propyl-piperazine-1-carbothioamide Openeye Name: N-(3-nitrophenyl)-4-propyl-piperazine-1-carbothioamide CAS Name: N-(3-nitrophenyl)-4-propyl-1-piperazinecarbothioamide IUPAC Name: N-(3-nitrophenyl)-4-propylpiperazine-1-carbothioamide Traditional Name: N-(3-nitrophenyl)-4-propyl-piperazine-1-carbothioamide Formula: C14H20N4O2S MolecularWeight: 308.3992

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=S)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCN1CCN(CC1)C(=S)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

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