1-(3-ethanoylphenyl)-3-[2-(3-methyl-4-nitro-phenoxy)ethanoylamino]thiourea

Systemtic Name: 1-(3-ethanoylphenyl)-3-[2-(3-methyl-4-nitro-phenoxy)ethanoylamino]thiourea Openeye Name: 1-(3-acetylphenyl)-3-[[2-(3-methyl-4-nitro-phenoxy)acetyl]amino]thiourea CAS Name: 1-(3-acetylphenyl)-3-[[2-(3-methyl-4-nitrophenoxy)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3-acetylphenyl)-3-[[2-(3-methyl-4-nitrophenoxy)acetyl]amino]thiourea Traditional Name: 1-(3-acetylphenyl)-3-[[2-(3-methyl-4-nitro-phenoxy)acetyl]amino]thiourea Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NNC(=S)NC2=CC=CC(=C2)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NNC(=S)NC2=CC=CC(=C2)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O5S/c1-11-8-15(6-7-16(11)22(25)26)27-10-17(24)20-21-18(28)19-14-5-3-4-13(9-14)12(2)23/h3-9H,10H2,1-2H3,(H,20,24)(H2,19,21,28)