1-(3,5-dimethoxyphenyl)-3-[2-(4-nitrophenoxy)ethanoylamino]thiourea

Systemtic Name: 1-(3,5-dimethoxyphenyl)-3-[2-(4-nitrophenoxy)ethanoylamino]thiourea Openeye Name: 1-(3,5-dimethoxyphenyl)-3-[[2-(4-nitrophenoxy)acetyl]amino]thiourea CAS Name: 1-(3,5-dimethoxyphenyl)-3-[[2-(4-nitrophenoxy)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3,5-dimethoxyphenyl)-3-[[2-(4-nitrophenoxy)acetyl]amino]thiourea Traditional Name: 1-(3,5-dimethoxyphenyl)-3-[[2-(4-nitrophenoxy)acetyl]amino]thiourea Formula: C17H18N4O6S MolecularWeight: 406.41302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=S)NNC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=S)NNC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H18N4O6S/c1-25-14-7-11(8-15(9-14)26-2)18-17(28)20-19-16(22)10-27-13-5-3-12(4-6-13)21(23)24/h3-9H,10H2,1-2H3,(H,19,22)(H2,18,20,28)