1-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethanoylamino]-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethanoylamino]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)acetyl]amino]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[[2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-1-oxoethyl]amino]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[[2-(4-bromo-3,5-dimethylpyrazol-1-yl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)acetyl]amino]-3-(tetrahydrofurfuryl)thiourea Formula: C13H20BrN5O2S MolecularWeight: 390.2992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NNC(=S)NCC2CCCO2)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NNC(=S)NCC2CCCO2)C)Br

InChI

InChI=1S/C13H20BrN5O2S/c1-8-12(14)9(2)19(18-8)7-11(20)16-17-13(22)15-6-10-4-3-5-21-10/h10H,3-7H2,1-2H3,(H,16,20)(H2,15,17,22)