1-[(2R)-4-methylsulfanyl-1-oxidanylidene-1-[2-[(3-phenyl-1H-pyrazol-5-yl)carbonyl]hydrazinyl]butan-2-yl]urea

Systemtic Name: 1-[(2R)-4-methylsulfanyl-1-oxidanylidene-1-[2-[(3-phenyl-1H-pyrazol-5-yl)carbonyl]hydrazinyl]butan-2-yl]urea Openeye Name: [(1R)-3-methylsulfanyl-1-[[(3-phenyl-1H-pyrazole-5-carbonyl)amino]carbamoyl]propyl]urea CAS Name: [(2R)-4-(methylthio)-1-oxo-1-[[oxo-(3-phenyl-1H-pyrazol-5-yl)methyl]hydrazo]butan-2-yl]urea IUPAC Name: [(2R)-4-methylsulfanyl-1-oxo-1-[2-(3-phenyl-1H-pyrazole-5-carbonyl)hydrazinyl]butan-2-yl]urea Traditional Name: [(1R)-3-(methylthio)-1-[[(3-phenyl-1H-pyrazole-5-carbonyl)amino]carbamoyl]propyl]urea Formula: C16H20N6O3S MolecularWeight: 376.4334

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NNC(=O)C1=CC(=NN1)C2=CC=CC=C2)NC(=O)N

Isomeric SMILES

CSCC[C@H](C(=O)NNC(=O)C1=CC(=NN1)C2=CC=CC=C2)NC(=O)N

InChI

InChI=1S/C16H20N6O3S/c1-26-8-7-11(18-16(17)25)14(23)21-22-15(24)13-9-12(19-20-13)10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H,19,20)(H,21,23)(H,22,24)(H3,17,18,25)/t11-/m1/s1