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

Systemtic Name: 1-[(4-bromanyl-1,5-dimethyl-pyrazol-3-yl)carbonylamino]-1-(2-methoxyphenyl)thiourea Openeye Name: 1-[(4-bromo-1,5-dimethyl-pyrazole-3-carbonyl)amino]-1-(2-methoxyphenyl)thiourea CAS Name: 1-[[(4-bromo-1,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]-1-(2-methoxyphenyl)thiourea IUPAC Name: 1-[(4-bromo-1,5-dimethylpyrazole-3-carbonyl)amino]-1-(2-methoxyphenyl)thiourea Traditional Name: 1-[(4-bromo-1,5-dimethyl-pyrazole-3-carbonyl)amino]-1-(2-methoxyphenyl)thiourea Formula: C14H16BrN5O2S MolecularWeight: 398.27814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)NN(C2=CC=CC=C2OC)C(=S)N)Br

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)NN(C2=CC=CC=C2OC)C(=S)N)Br

InChI

InChI=1S/C14H16BrN5O2S/c1-8-11(15)12(17-19(8)2)13(21)18-20(14(16)23)9-6-4-5-7-10(9)22-3/h4-7H,1-3H3,(H2,16,23)(H,18,21)