1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-homoveratryl-thiourea Formula: C19H28N4O2S MolecularWeight: 376.51622

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CNC(=S)NCCC2=CC(=C(C=C2)OC)OC)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CNC(=S)NCCC2=CC(=C(C=C2)OC)OC)C

InChI

InChI=1S/C19H28N4O2S/c1-6-23-14(3)16(13(2)22-23)12-21-19(26)20-10-9-15-7-8-17(24-4)18(11-15)25-5/h7-8,11H,6,9-10,12H2,1-5H3,(H2,20,21,26)