1-[[(3S)-4-fluoranyl-3-methyl-7-oxidanylidene-2,3-dihydroinden-1-yl]amino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[[(3S)-4-fluoranyl-3-methyl-7-oxidanylidene-2,3-dihydroinden-1-yl]amino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[[(3S)-4-fluoro-3-methyl-7-oxo-2,3-dihydroinden-1-yl]amino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[[(3S)-4-fluoro-3-methyl-7-oxo-2,3-dihydroinden-1-yl]amino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[[(3S)-4-fluoro-3-methyl-7-oxo-2,3-dihydroinden-1-yl]amino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[[(3S)-4-fluoro-7-keto-3-methyl-2,3-dihydroinden-1-yl]amino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C17H24FN4O2S+ MolecularWeight: 367.461463

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=C2C1=C(C=CC2=O)F)NNC(=S)NCC[NH+]3CCOCC3

Isomeric SMILES

C[C@H]1CC(=C2C1=C(C=CC2=O)F)NNC(=S)NCC[NH+]3CCOCC3

InChI

InChI=1S/C17H23FN4O2S/c1-11-10-13(16-14(23)3-2-12(18)15(11)16)20-21-17(25)19-4-5-22-6-8-24-9-7-22/h2-3,11,20H,4-10H2,1H3,(H2,19,21,25)/p+1/t11-/m0/s1