N-(2-methoxy-4-nitro-phenyl)-4-propyl-piperazine-1-carbothioamide hydrobromide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-4-propyl-piperazine-1-carbothioamide hydrobromide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-4-propyl-piperazine-1-carbothioamide hydrobromide CAS Name: N-(2-methoxy-4-nitrophenyl)-4-propyl-1-piperazinecarbothioamide hydrobromide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-4-propylpiperazine-1-carbothioamide hydrobromide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-4-propyl-piperazine-1-carbothioamide hydrobromide Formula: C15H23BrN4O3S MolecularWeight: 419.33712

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC.Br

Isomeric SMILES

CCCN1CCN(CC1)C(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC.Br

InChI

InChI=1S/C15H22N4O3S.BrH/c1-3-6-17-7-9-18(10-8-17)15(23)16-13-5-4-12(19(20)21)11-14(13)22-2;/h4-5,11H,3,6-10H2,1-2H3,(H,16,23);1H