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

Systemtic Name: 1-[(4-chloranyl-2,5-dimethyl-pyrazol-3-yl)carbonylamino]-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[(4-chloro-2,5-dimethyl-pyrazole-3-carbonyl)amino]thiourea CAS Name: 1-[[(4-chloro-2,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(4-chloro-2,5-dimethylpyrazole-3-carbonyl)amino]thiourea Traditional Name: 1-benzyl-1-[(4-chloro-2,5-dimethyl-pyrazole-3-carbonyl)amino]thiourea Formula: C14H16ClN5OS MolecularWeight: 337.82774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Cl)C(=O)NN(CC2=CC=CC=C2)C(=S)N)C

Isomeric SMILES

CC1=NN(C(=C1Cl)C(=O)NN(CC2=CC=CC=C2)C(=S)N)C

InChI

InChI=1S/C14H16ClN5OS/c1-9-11(15)12(19(2)17-9)13(21)18-20(14(16)22)8-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H2,16,22)(H,18,21)