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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[1-[(4-fluorophenyl)methyl]-3-pyrazolyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-fluorobenzyl)pyrazol-3-yl]thiourea Formula: C18H15FN4O2S MolecularWeight: 370.400703

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=NN(C=C3)CC4=CC=C(C=C4)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=NN(C=C3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C18H15FN4O2S/c19-13-3-1-12(2-4-13)10-23-8-7-17(22-23)21-18(26)20-14-5-6-15-16(9-14)25-11-24-15/h1-9H,10-11H2,(H2,20,21,22,26)