1-[2-(2,6-dimethylphenoxy)ethanoylamino]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[2-(2,6-dimethylphenoxy)ethanoylamino]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[[2-(2,6-dimethylphenoxy)acetyl]amino]-3-(4-nitrophenyl)thiourea CAS Name: 1-[[2-(2,6-dimethylphenoxy)-1-oxoethyl]amino]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[[2-(2,6-dimethylphenoxy)acetyl]amino]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[[2-(2,6-dimethylphenoxy)acetyl]amino]-3-(4-nitrophenyl)thiourea Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O4S/c1-11-4-3-5-12(2)16(11)25-10-15(22)19-20-17(26)18-13-6-8-14(9-7-13)21(23)24/h3-9H,10H2,1-2H3,(H,19,22)(H2,18,20,26)