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

Systemtic Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(3-fluoranyl-4-methyl-phenyl)thiourea Openeye Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(3-fluoro-4-methyl-phenyl)thiourea CAS Name: 1-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-(3-fluoro-4-methylphenyl)thiourea IUPAC Name: 1-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-(3-fluoro-4-methylphenyl)thiourea Traditional Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(3-fluoro-4-methyl-phenyl)thiourea Formula: C20H21FN4S MolecularWeight: 368.470943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCC2=C(N(N=C2C)C3=CC=CC=C3)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCC2=C(N(N=C2C)C3=CC=CC=C3)C)F

InChI

InChI=1S/C20H21FN4S/c1-13-9-10-16(11-19(13)21)23-20(26)22-12-18-14(2)24-25(15(18)3)17-7-5-4-6-8-17/h4-11H,12H2,1-3H3,(H2,22,23,26)