4-(2-azanyl-1H-imidazol-5-yl)-N-cyclohexyl-piperidine-1-carbothioamide; 2,4,6-trinitrophenol

Systemtic Name: 4-(2-azanyl-1H-imidazol-5-yl)-N-cyclohexyl-piperidine-1-carbothioamide; 2,4,6-trinitrophenol Openeye Name: 4-(2-amino-1H-imidazol-5-yl)-N-cyclohexyl-piperidine-1-carbothioamide; picric acid CAS Name: 4-(2-amino-1H-imidazol-5-yl)-N-cyclohexyl-1-piperidinecarbothioamide; 2,4,6-trinitrophenol IUPAC Name: 4-(2-amino-1H-imidazol-5-yl)-N-cyclohexylpiperidine-1-carbothioamide; 2,4,6-trinitrophenol Traditional Name: 4-(2-amino-1H-imidazol-5-yl)-N-cyclohexyl-piperidine-1-carbothioamide; picric acid Formula: C21H28N8O7S MolecularWeight: 536.56142

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)N2CCC(CC2)C3=CN=C(N3)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=S)N2CCC(CC2)C3=CN=C(N3)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H25N5S.C6H3N3O7/c16-14-17-10-13(19-14)11-6-8-20(9-7-11)15(21)18-12-4-2-1-3-5-12;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h10-12H,1-9H2,(H,18,21)(H3,16,17,19);1-2,10H