1-[(4-oxidanyl-1-phenyl-pyrazol-3-yl)carbonylamino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[(4-oxidanyl-1-phenyl-pyrazol-3-yl)carbonylamino]-3-propan-2-yl-thiourea Openeye Name: 1-[(4-hydroxy-1-phenyl-pyrazole-3-carbonyl)amino]-3-isopropyl-thiourea CAS Name: 1-[[(4-hydroxy-1-phenyl-3-pyrazolyl)-oxomethyl]amino]-3-propan-2-ylthiourea IUPAC Name: 1-[(4-hydroxy-1-phenylpyrazole-3-carbonyl)amino]-3-propan-2-ylthiourea Traditional Name: 1-[(4-hydroxy-1-phenyl-pyrazole-3-carbonyl)amino]-3-isopropyl-thiourea Formula: C14H17N5O2S MolecularWeight: 319.38208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NNC(=O)C1=NN(C=C1O)C2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=S)NNC(=O)C1=NN(C=C1O)C2=CC=CC=C2

InChI

InChI=1S/C14H17N5O2S/c1-9(2)15-14(22)17-16-13(21)12-11(20)8-19(18-12)10-6-4-3-5-7-10/h3-9,20H,1-2H3,(H,16,21)(H2,15,17,22)