1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3-(4-nitrophenyl)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3-(4-nitrophenyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3-(4-nitrophenyl)thiourea Traditional Name: 1-homoveratryl-1-methyl-3-(4-nitrophenyl)thiourea Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4S/c1-20(11-10-13-4-9-16(24-2)17(12-13)25-3)18(26)19-14-5-7-15(8-6-14)21(22)23/h4-9,12H,10-11H2,1-3H3,(H,19,26)