1-(4-fluorophenyl)-3-[3-(phenylsulfonyl)propanoylamino]thiourea

Systemtic Name: 1-(4-fluorophenyl)-3-[3-(phenylsulfonyl)propanoylamino]thiourea Openeye Name: 1-[3-(benzenesulfonyl)propanoylamino]-3-(4-fluorophenyl)thiourea CAS Name: 1-[[3-(benzenesulfonyl)-1-oxopropyl]amino]-3-(4-fluorophenyl)thiourea IUPAC Name: 1-[3-(benzenesulfonyl)propanoylamino]-3-(4-fluorophenyl)thiourea Traditional Name: 1-(3-besylpropanoylamino)-3-(4-fluorophenyl)thiourea Formula: C16H16FN3O3S2 MolecularWeight: 381.444943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NNC(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NNC(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C16H16FN3O3S2/c17-12-6-8-13(9-7-12)18-16(24)20-19-15(21)10-11-25(22,23)14-4-2-1-3-5-14/h1-9H,10-11H2,(H,19,21)(H2,18,20,24)