1-butyl-3-[1-[(3-chloranylphenoxy)methyl]pyrazol-4-yl]thiourea

Systemtic Name: 1-butyl-3-[1-[(3-chloranylphenoxy)methyl]pyrazol-4-yl]thiourea Openeye Name: 1-butyl-3-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]thiourea CAS Name: 1-butyl-3-[1-[(3-chlorophenoxy)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-butyl-3-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]thiourea Traditional Name: 1-butyl-3-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]thiourea Formula: C15H19ClN4OS MolecularWeight: 338.85556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CN(N=C1)COC2=CC(=CC=C2)Cl

Isomeric SMILES

CCCCNC(=S)NC1=CN(N=C1)COC2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H19ClN4OS/c1-2-3-7-17-15(22)19-13-9-18-20(10-13)11-21-14-6-4-5-12(16)8-14/h4-6,8-10H,2-3,7,11H2,1H3,(H2,17,19,22)