1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(furan-2-ylmethyl)thiourea

Systemtic Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(furan-2-ylmethyl)thiourea Openeye Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(2-furylmethyl)thiourea CAS Name: 1-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-(2-furanylmethyl)thiourea IUPAC Name: 1-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-(furan-2-ylmethyl)thiourea Traditional Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(2-furfuryl)thiourea Formula: C18H20N4OS MolecularWeight: 340.4426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=S)NCC3=CC=CO3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=S)NCC3=CC=CO3

InChI

InChI=1S/C18H20N4OS/c1-13-17(12-20-18(24)19-11-16-9-6-10-23-16)14(2)22(21-13)15-7-4-3-5-8-15/h3-10H,11-12H2,1-2H3,(H2,19,20,24)