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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)N1C2=C(C=C(C=C2)Cl)SC3=CC=CC=C31)C(=O)NC(CC(=O)O)C(=O)CF

Isomeric SMILES

CC(C)[C@H](CC(=O)N1C2=C(C=C(C=C2)Cl)SC3=CC=CC=C31)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)34-21-9-14(25)7-8-18(21)28/h3-9,13,15-16H,10-12H2,1-2H3,(H,27,33)(H,31,32)/t15-,16?/m0/s1