1-(3,5-dimethylphenyl)-3-[2-(2-nitrophenoxy)ethanoylamino]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[2-(2-nitrophenoxy)ethanoylamino]thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[[2-(2-nitrophenoxy)acetyl]amino]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[[2-(2-nitrophenoxy)acetyl]amino]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-[[2-(2-nitrophenoxy)acetyl]amino]thiourea Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NNC(=O)COC2=CC=CC=C2[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NNC(=O)COC2=CC=CC=C2[N+](=O)[O-])C

InChI

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