3-(2-chloranylphenothiazin-10-yl)-N,N-diethyl-propan-1-amine; (2S)-5-oxidanylidenepyrrolidine-2-carboxylic acid

Systemtic Name: 3-(2-chloranylphenothiazin-10-yl)-N,N-diethyl-propan-1-amine; (2S)-5-oxidanylidenepyrrolidine-2-carboxylic acid Openeye Name: 3-(2-chlorophenothiazin-10-yl)-N,N-diethyl-propan-1-amine; (2S)-5-oxopyrrolidine-2-carboxylic acid CAS Name: 3-(2-chloro-10-phenothiazinyl)-N,N-diethyl-1-propanamine; (2S)-5-oxo-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(2-chlorophenothiazin-10-yl)-N,N-diethylpropan-1-amine; (2S)-5-oxopyrrolidine-2-carboxylic acid Traditional Name: 3-(2-chlorophenothiazin-10-yl)propyl-diethyl-amine; (2S)-5-ketoproline Formula: C24H30ClN3O3S MolecularWeight: 476.0313

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.C1CC(=O)NC1C(=O)O

Isomeric SMILES

CCN(CC)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.C1CC(=O)N[C@@H]1C(=O)O

InChI

InChI=1S/C19H23ClN2S.C5H7NO3/c1-3-21(4-2)12-7-13-22-16-8-5-6-9-18(16)23-19-11-10-15(20)14-17(19)22;7-4-2-1-3(6-4)5(8)9/h5-6,8-11,14H,3-4,7,12-13H2,1-2H3;3H,1-2H2,(H,6,7)(H,8,9)/t;3-/m.0/s1