1-[3-(4-bromanylpyrazol-1-yl)propyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea

Systemtic Name: 1-[3-(4-bromanylpyrazol-1-yl)propyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Openeye Name: 1-[3-(4-bromopyrazol-1-yl)propyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea CAS Name: 1-[3-(4-bromo-1-pyrazolyl)propyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1-[3-(4-bromopyrazol-1-yl)propyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-[3-(4-bromopyrazol-1-yl)propyl]-3-homoveratryl-thiourea Formula: C17H23BrN4O2S MolecularWeight: 427.35912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NCCCN2C=C(C=N2)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NCCCN2C=C(C=N2)Br)OC

InChI

InChI=1S/C17H23BrN4O2S/c1-23-15-5-4-13(10-16(15)24-2)6-8-20-17(25)19-7-3-9-22-12-14(18)11-21-22/h4-5,10-12H,3,6-9H2,1-2H3,(H2,19,20,25)