1-(2-fluorophenyl)-3-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-(2-fluorophenyl)-3-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(2-fluorophenyl)-3-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-(2-fluorophenyl)-3-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(2-fluorophenyl)-3-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(2-fluorophenyl)-3-(2-methoxy-5-piperidinosulfonyl-phenyl)thiourea Formula: C19H22FN3O3S2 MolecularWeight: 423.524683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=S)NC3=CC=CC=C3F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=S)NC3=CC=CC=C3F

InChI

InChI=1S/C19H22FN3O3S2/c1-26-18-10-9-14(28(24,25)23-11-5-2-6-12-23)13-17(18)22-19(27)21-16-8-4-3-7-15(16)20/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H2,21,22,27)