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

Systemtic Name: 1-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-3-(3-ethoxypropyl)thiourea Openeye Name: 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-3-(3-ethoxypropyl)thiourea CAS Name: 1-[[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-1-oxopropyl]amino]-3-(3-ethoxypropyl)thiourea IUPAC Name: 1-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-(3-ethoxypropyl)thiourea Traditional Name: 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-3-(3-ethoxypropyl)thiourea Formula: C14H24BrN5O2S MolecularWeight: 406.34166

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NNC(=O)CCN1C(=C(C(=N1)C)Br)C

Isomeric SMILES

CCOCCCNC(=S)NNC(=O)CCN1C(=C(C(=N1)C)Br)C

InChI

InChI=1S/C14H24BrN5O2S/c1-4-22-9-5-7-16-14(23)18-17-12(21)6-8-20-11(3)13(15)10(2)19-20/h4-9H2,1-3H3,(H,17,21)(H2,16,18,23)