1-[[2-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-3-(4-fluorophenyl)thiourea

Systemtic Name: 1-[[2-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-3-(4-fluorophenyl)thiourea Openeye Name: 1-[(2-butyl-1,3-dioxo-isoindoline-5-carbonyl)amino]-3-(4-fluorophenyl)thiourea CAS Name: 1-[[(2-butyl-1,3-dioxo-5-isoindolyl)-oxomethyl]amino]-3-(4-fluorophenyl)thiourea IUPAC Name: 1-[(2-butyl-1,3-dioxoisoindole-5-carbonyl)amino]-3-(4-fluorophenyl)thiourea Traditional Name: 1-[(2-butyl-1,3-diketo-isoindoline-5-carbonyl)amino]-3-(4-fluorophenyl)thiourea Formula: C20H19FN4O3S MolecularWeight: 414.453263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NNC(=S)NC3=CC=C(C=C3)F

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NNC(=S)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H19FN4O3S/c1-2-3-10-25-18(27)15-9-4-12(11-16(15)19(25)28)17(26)23-24-20(29)22-14-7-5-13(21)6-8-14/h4-9,11H,2-3,10H2,1H3,(H,23,26)(H2,22,24,29)