1-[1-(1-ethyl-5-methyl-pyrazol-4-yl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[1-(1-ethyl-5-methyl-pyrazol-4-yl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[1-(1-ethyl-5-methyl-pyrazol-4-yl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[1-(1-ethyl-5-methyl-4-pyrazolyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[1-(1-ethyl-5-methylpyrazol-4-yl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[1-(1-ethyl-5-methyl-pyrazol-4-yl)ethyl]-3-(4-fluorobenzyl)thiourea Formula: C16H21FN4S MolecularWeight: 320.428143

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C(C)NC(=S)NCC2=CC=C(C=C2)F)C

Isomeric SMILES

CCN1C(=C(C=N1)C(C)NC(=S)NCC2=CC=C(C=C2)F)C

InChI

InChI=1S/C16H21FN4S/c1-4-21-12(3)15(10-19-21)11(2)20-16(22)18-9-13-5-7-14(17)8-6-13/h5-8,10-11H,4,9H2,1-3H3,(H2,18,20,22)