1-[(4-chloranyl-2,5-dimethyl-pyrazol-3-yl)carbonylamino]-3-(3-ethoxypropyl)thiourea

Systemtic Name: 1-[(4-chloranyl-2,5-dimethyl-pyrazol-3-yl)carbonylamino]-3-(3-ethoxypropyl)thiourea Openeye Name: 1-[(4-chloro-2,5-dimethyl-pyrazole-3-carbonyl)amino]-3-(3-ethoxypropyl)thiourea CAS Name: 1-[[(4-chloro-2,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]-3-(3-ethoxypropyl)thiourea IUPAC Name: 1-[(4-chloro-2,5-dimethylpyrazole-3-carbonyl)amino]-3-(3-ethoxypropyl)thiourea Traditional Name: 1-[(4-chloro-2,5-dimethyl-pyrazole-3-carbonyl)amino]-3-(3-ethoxypropyl)thiourea Formula: C12H20ClN5O2S MolecularWeight: 333.8375

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NNC(=O)C1=C(C(=NN1C)C)Cl

Isomeric SMILES

CCOCCCNC(=S)NNC(=O)C1=C(C(=NN1C)C)Cl

InChI

InChI=1S/C12H20ClN5O2S/c1-4-20-7-5-6-14-12(21)16-15-11(19)10-9(13)8(2)17-18(10)3/h4-7H2,1-3H3,(H,15,19)(H2,14,16,21)