1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC)OC

InChI

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