3-[[(2S)-4-(2-chloranylphenothiazin-10-yl)-4-oxidanylidene-2-propan-2-yl-butanoyl]amino]-5-fluoranyl-4-oxidanylidene-pentanoic acid

Systemtic Name: 3-[[(2S)-4-(2-chloranylphenothiazin-10-yl)-4-oxidanylidene-2-propan-2-yl-butanoyl]amino]-5-fluoranyl-4-oxidanylidene-pentanoic acid Openeye Name: 3-[[(2S)-4-(2-chlorophenothiazin-10-yl)-2-isopropyl-4-oxo-butanoyl]amino]-5-fluoro-4-oxo-pentanoic acid CAS Name: 3-[[(2S)-4-(2-chloro-10-phenothiazinyl)-1,4-dioxo-2-propan-2-ylbutyl]amino]-5-fluoro-4-oxopentanoic acid IUPAC Name: 3-[[(2S)-4-(2-chlorophenothiazin-10-yl)-4-oxo-2-propan-2-ylbutanoyl]amino]-5-fluoro-4-oxopentanoic acid Traditional Name: 3-[[(2S)-4-(2-chlorophenothiazin-10-yl)-2-isopropyl-4-keto-butanoyl]amino]-5-fluoro-4-keto-valeric acid Formula: C24H24ClFN2O5S MolecularWeight: 506.974163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl)C(=O)NC(CC(=O)O)C(=O)CF

Isomeric SMILES

CC(C)[C@H](CC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl)C(=O)NC(CC(=O)O)C(=O)CF

InChI

InChI=1S/C24H24ClFN2O5S/c1-13(2)15(24(33)27-16(11-23(31)32)19(29)12-26)10-22(30)28-17-5-3-4-6-20(17)34-21-8-7-14(25)9-18(21)28/h3-9,13,15-16H,10-12H2,1-2H3,(H,27,33)(H,31,32)/t15-,16?/m0/s1