1-(3-fluoranyl-4-methyl-phenyl)-3-[(2R)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]thiourea

Systemtic Name: 1-(3-fluoranyl-4-methyl-phenyl)-3-[(2R)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]thiourea Openeye Name: 1-(3-fluoro-4-methyl-phenyl)-3-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]thiourea CAS Name: 1-(3-fluoro-4-methylphenyl)-3-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]thiourea IUPAC Name: 1-(3-fluoro-4-methylphenyl)-3-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]thiourea Traditional Name: 1-(3-fluoro-4-methyl-phenyl)-3-[(2R)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]thiourea Formula: C17H16FN3O2S MolecularWeight: 345.391243

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=S)NC3=CC(=C(C=C3)C)F

Isomeric SMILES

C[C@@H]1C(=O)NC2=C(O1)C=CC(=C2)NC(=S)NC3=CC(=C(C=C3)C)F

InChI

InChI=1S/C17H16FN3O2S/c1-9-3-4-11(7-13(9)18)19-17(24)20-12-5-6-15-14(8-12)21-16(22)10(2)23-15/h3-8,10H,1-2H3,(H,21,22)(H2,19,20,24)/t10-/m1/s1