1-[(2S,3S)-1-[2-[(2-ethyl-6-methyl-phenyl)carbamothioyl]hydrazinyl]-3-methyl-1-oxidanylidene-pentan-2-yl]urea

Systemtic Name: 1-[(2S,3S)-1-[2-[(2-ethyl-6-methyl-phenyl)carbamothioyl]hydrazinyl]-3-methyl-1-oxidanylidene-pentan-2-yl]urea Openeye Name: [(1S,2S)-1-[[(2-ethyl-6-methyl-phenyl)carbamothioylamino]carbamoyl]-2-methyl-butyl]urea CAS Name: [(2S,3S)-1-[[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]hydrazo]-3-methyl-1-oxopentan-2-yl]urea IUPAC Name: [(2S,3S)-1-[2-[(2-ethyl-6-methylphenyl)carbamothioyl]hydrazinyl]-3-methyl-1-oxopentan-2-yl]urea Traditional Name: [(1S,2S)-1-[[(2-ethyl-6-methyl-phenyl)thiocarbamoylamino]carbamoyl]-2-methyl-butyl]urea Formula: C17H27N5O2S MolecularWeight: 365.49358

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C(C(C)CC)NC(=O)N)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)[C@H]([C@@H](C)CC)NC(=O)N)C

InChI

InChI=1S/C17H27N5O2S/c1-5-10(3)14(19-16(18)24)15(23)21-22-17(25)20-13-11(4)8-7-9-12(13)6-2/h7-10,14H,5-6H2,1-4H3,(H,21,23)(H3,18,19,24)(H2,20,22,25)/t10-,14-/m0/s1