1-(3-chloranyl-4-fluoranyl-phenyl)-3-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(2-methoxy-5-piperidinosulfonyl-phenyl)thiourea Formula: C19H21ClFN3O3S2 MolecularWeight: 457.969743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H21ClFN3O3S2/c1-27-18-8-6-14(29(25,26)24-9-3-2-4-10-24)12-17(18)23-19(28)22-13-5-7-16(21)15(20)11-13/h5-8,11-12H,2-4,9-10H2,1H3,(H2,22,23,28)