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

Systemtic Name: 1-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethanoylamino]-3-(3-methoxypropyl)thiourea Openeye Name: 1-[[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)acetyl]amino]-3-(3-methoxypropyl)thiourea CAS Name: 1-[[2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-1-oxoethyl]amino]-3-(3-methoxypropyl)thiourea IUPAC Name: 1-[[2-(4-bromo-3,5-dimethylpyrazol-1-yl)acetyl]amino]-3-(3-methoxypropyl)thiourea Traditional Name: 1-[[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)acetyl]amino]-3-(3-methoxypropyl)thiourea Formula: C12H20BrN5O2S MolecularWeight: 378.2885

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20BrN5O2S/c1-8-11(13)9(2)18(17-8)7-10(19)15-16-12(21)14-5-4-6-20-3/h4-7H2,1-3H3,(H,15,19)(H2,14,16,21)