1-cyclopentyl-3-[[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]phenyl]carbonylamino]thiourea

Systemtic Name: 1-cyclopentyl-3-[[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]phenyl]carbonylamino]thiourea Openeye Name: 1-cyclopentyl-3-[[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzoyl]amino]thiourea CAS Name: 1-cyclopentyl-3-[[[4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea Traditional Name: 1-cyclopentyl-3-[[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzoyl]amino]thiourea Formula: C19H24N6O3S MolecularWeight: 416.49726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NNC(=S)NC3CCCC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NNC(=S)NC3CCCC3)C)[N+](=O)[O-]

InChI

InChI=1S/C19H24N6O3S/c1-12-17(25(27)28)13(2)24(23-12)11-14-7-9-15(10-8-14)18(26)21-22-19(29)20-16-5-3-4-6-16/h7-10,16H,3-6,11H2,1-2H3,(H,21,26)(H2,20,22,29)