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

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-methylpyrazol-4-yl)methyl]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-methylpyrazol-4-yl)methyl]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-methyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-methylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-homoveratryl-3-[(1-methylpyrazol-4-yl)methyl]thiourea Formula: C16H22N4O2S MolecularWeight: 334.43648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC(=S)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CN1C=C(C=N1)CNC(=S)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C16H22N4O2S/c1-20-11-13(10-19-20)9-18-16(23)17-7-6-12-4-5-14(21-2)15(8-12)22-3/h4-5,8,10-11H,6-7,9H2,1-3H3,(H2,17,18,23)