1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethanoylamino]-3-(3-methoxyphenyl)thiourea

Systemtic Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethanoylamino]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[[2-(4,5-dimethoxy-2-nitro-phenyl)acetyl]amino]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[[2-(4,5-dimethoxy-2-nitrophenyl)-1-oxoethyl]amino]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[[2-(4,5-dimethoxy-2-nitrophenyl)acetyl]amino]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[[2-(4,5-dimethoxy-2-nitro-phenyl)acetyl]amino]-3-(3-methoxyphenyl)thiourea Formula: C18H20N4O6S MolecularWeight: 420.4396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NNC(=O)CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NNC(=O)CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H20N4O6S/c1-26-13-6-4-5-12(9-13)19-18(29)21-20-17(23)8-11-7-15(27-2)16(28-3)10-14(11)22(24)25/h4-7,9-10H,8H2,1-3H3,(H,20,23)(H2,19,21,29)