(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) (2R)-2-benzamido-4-methyl-pentanoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) (2R)-2-benzamido-4-methyl-pentanoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) (2R)-2-benzamido-4-methyl-pentanoate CAS Name: (2R)-2-benzamido-4-methylpentanoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) (2R)-2-benzamido-4-methylpentanoate Traditional Name: (2R)-2-benzamido-4-methyl-valeric acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C27H26N2O4S MolecularWeight: 474.57134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)C[C@H](C(=O)OCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H26N2O4S/c1-18(2)16-20(28-26(31)19-10-4-3-5-11-19)27(32)33-17-25(30)29-21-12-6-8-14-23(21)34-24-15-9-7-13-22(24)29/h3-15,18,20H,16-17H2,1-2H3,(H,28,31)/t20-/m1/s1