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

Systemtic Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(3-methoxyphenyl)thiourea Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H21N3O5S/c1-24-14-6-4-5-13(10-14)20-18(27)19-8-7-12-9-16(25-2)17(26-3)11-15(12)21(22)23/h4-6,9-11H,7-8H2,1-3H3,(H2,19,20,27)