1-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(3-ethoxypropyl)thiourea

Systemtic Name: 1-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(3-ethoxypropyl)thiourea Openeye Name: 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(3-ethoxypropyl)thiourea CAS Name: 1-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-3-(3-ethoxypropyl)thiourea IUPAC Name: 1-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-3-(3-ethoxypropyl)thiourea Traditional Name: 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(3-ethoxypropyl)thiourea Formula: C14H25BrN4OS MolecularWeight: 377.3435

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NCCCN1C(=C(C(=N1)C)Br)C

Isomeric SMILES

CCOCCCNC(=S)NCCCN1C(=C(C(=N1)C)Br)C

InChI

InChI=1S/C14H25BrN4OS/c1-4-20-10-6-8-17-14(21)16-7-5-9-19-12(3)13(15)11(2)18-19/h4-10H2,1-3H3,(H2,16,17,21)