[4-(diethylamino)phenyl]-[4-(2-nitrophenyl)piperazin-1-yl]methanethione

Systemtic Name: [4-(diethylamino)phenyl]-[4-(2-nitrophenyl)piperazin-1-yl]methanethione Openeye Name: [4-(diethylamino)phenyl]-[4-(2-nitrophenyl)piperazin-1-yl]methanethione CAS Name: [4-(diethylamino)phenyl]-[4-(2-nitrophenyl)-1-piperazinyl]methanethione IUPAC Name: [4-(diethylamino)phenyl]-[4-(2-nitrophenyl)piperazin-1-yl]methanethione Traditional Name: [4-(diethylamino)phenyl]-[4-(2-nitrophenyl)piperazino]methanethione Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=S)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=S)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O2S/c1-3-22(4-2)18-11-9-17(10-12-18)21(28)24-15-13-23(14-16-24)19-7-5-6-8-20(19)25(26)27/h5-12H,3-4,13-16H2,1-2H3