1-(4-methyl-2-nitro-phenyl)-3-(4-methylpiperazin-1-yl)thiourea

Systemtic Name: 1-(4-methyl-2-nitro-phenyl)-3-(4-methylpiperazin-1-yl)thiourea Openeye Name: 1-(4-methyl-2-nitro-phenyl)-3-(4-methylpiperazin-1-yl)thiourea CAS Name: 1-(4-methyl-2-nitrophenyl)-3-(4-methyl-1-piperazinyl)thiourea IUPAC Name: 1-(4-methyl-2-nitrophenyl)-3-(4-methylpiperazin-1-yl)thiourea Traditional Name: 1-(4-methyl-2-nitro-phenyl)-3-(4-methylpiperazino)thiourea Formula: C13H19N5O2S MolecularWeight: 309.38726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NN2CCN(CC2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NN2CCN(CC2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H19N5O2S/c1-10-3-4-11(12(9-10)18(19)20)14-13(21)15-17-7-5-16(2)6-8-17/h3-4,9H,5-8H2,1-2H3,(H2,14,15,21)