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

Systemtic Name: 1-(4-methoxy-2-nitro-phenyl)-3-(4-methylpiperazin-1-yl)thiourea Openeye Name: 1-(4-methoxy-2-nitro-phenyl)-3-(4-methylpiperazin-1-yl)thiourea CAS Name: 1-(4-methoxy-2-nitrophenyl)-3-(4-methyl-1-piperazinyl)thiourea IUPAC Name: 1-(4-methoxy-2-nitrophenyl)-3-(4-methylpiperazin-1-yl)thiourea Traditional Name: 1-(4-methoxy-2-nitro-phenyl)-3-(4-methylpiperazino)thiourea Formula: C13H19N5O3S MolecularWeight: 325.38666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC(=S)NC2=C(C=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)NC(=S)NC2=C(C=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H19N5O3S/c1-16-5-7-17(8-6-16)15-13(22)14-11-4-3-10(21-2)9-12(11)18(19)20/h3-4,9H,5-8H2,1-2H3,(H2,14,15,22)