1-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-3-propan-2-yl-thiourea

Systemtic Name: 1-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-3-propan-2-yl-thiourea Openeye Name: 1-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-4-yl]-3-isopropyl-thiourea CAS Name: 1-[1-[(2-chloro-4-fluorophenyl)methyl]-4-pyrazolyl]-3-propan-2-ylthiourea IUPAC Name: 1-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-4-yl]-3-propan-2-ylthiourea Traditional Name: 1-[1-(2-chloro-4-fluoro-benzyl)pyrazol-4-yl]-3-isopropyl-thiourea Formula: C14H16ClFN4S MolecularWeight: 326.820043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NC1=CN(N=C1)CC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

CC(C)NC(=S)NC1=CN(N=C1)CC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C14H16ClFN4S/c1-9(2)18-14(21)19-12-6-17-20(8-12)7-10-3-4-11(16)5-13(10)15/h3-6,8-9H,7H2,1-2H3,(H2,18,19,21)