1-cyclopentyl-3-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanylethanoylamino]thiourea

Systemtic Name: 1-cyclopentyl-3-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanylethanoylamino]thiourea Openeye Name: 1-cyclopentyl-3-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanylacetyl]amino]thiourea CAS Name: 1-cyclopentyl-3-[[2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)thio]-1-oxoethyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfanylacetyl]amino]thiourea Traditional Name: 1-cyclopentyl-3-[[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)thio]acetyl]amino]thiourea Formula: C19H25N5OS2 MolecularWeight: 403.5647

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)SCC(=O)NNC(=S)NC3CCCC3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)SCC(=O)NNC(=S)NC3CCCC3

InChI

InChI=1S/C19H25N5OS2/c1-13-18(14(2)24(23-13)16-10-4-3-5-11-16)27-12-17(25)21-22-19(26)20-15-8-6-7-9-15/h3-5,10-11,15H,6-9,12H2,1-2H3,(H,21,25)(H2,20,22,26)