[10-[4-(dimethylamino)butyl]phenothiazin-2-yl]-phenyl-methanone; ethanedioic acid

Systemtic Name: [10-[4-(dimethylamino)butyl]phenothiazin-2-yl]-phenyl-methanone; ethanedioic acid Openeye Name: [10-[4-(dimethylamino)butyl]phenothiazin-2-yl]-phenyl-methanone; oxalic acid CAS Name: [10-[4-(dimethylamino)butyl]-2-phenothiazinyl]-phenylmethanone; oxalic acid IUPAC Name: [10-[4-(dimethylamino)butyl]phenothiazin-2-yl]-phenylmethanone; oxalic acid Traditional Name: [10-[4-(dimethylamino)butyl]phenothiazin-2-yl]-phenyl-methanone; oxalic acid Formula: C27H28N2O5S MolecularWeight: 492.58662

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(=O)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CN(C)CCCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(=O)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H26N2OS.C2H2O4/c1-26(2)16-8-9-17-27-21-12-6-7-13-23(21)29-24-15-14-20(18-22(24)27)25(28)19-10-4-3-5-11-19;3-1(4)2(5)6/h3-7,10-15,18H,8-9,16-17H2,1-2H3;(H,3,4)(H,5,6)