1-(4-fluorophenyl)-3-(4-methoxy-2-piperidin-1-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-(4-fluorophenyl)-3-(4-methoxy-2-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(4-fluorophenyl)-3-[4-methoxy-2-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-(4-fluorophenyl)-3-[4-methoxy-2-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(4-fluorophenyl)-3-(4-methoxy-2-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(4-fluorophenyl)-3-(4-methoxy-2-piperidinosulfonyl-phenyl)thiourea Formula: C19H22FN3O3S2 MolecularWeight: 423.524683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=S)NC2=CC=C(C=C2)F)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=S)NC2=CC=C(C=C2)F)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H22FN3O3S2/c1-26-16-9-10-17(22-19(27)21-15-7-5-14(20)6-8-15)18(13-16)28(24,25)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12H2,1H3,(H2,21,22,27)