1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-pyrazol-5-ylmethyl)thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-pyrazol-5-ylmethyl)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-pyrazol-5-ylmethyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-pyrazol-5-ylmethyl)thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-pyrazol-5-ylmethyl)thiourea Traditional Name: 1-homoveratryl-3-(1H-pyrazol-5-ylmethyl)thiourea Formula: C15H20N4O2S MolecularWeight: 320.4099

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NCC2=CC=NN2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NCC2=CC=NN2)OC

InChI

InChI=1S/C15H20N4O2S/c1-20-13-4-3-11(9-14(13)21-2)5-7-16-15(22)17-10-12-6-8-18-19-12/h3-4,6,8-9H,5,7,10H2,1-2H3,(H,18,19)(H2,16,17,22)