10-[1-(dimethylamino)propan-2-yl]-N-(phenylmethyl)phenothiazine-2-carboxamide; ethanedioic acid

Systemtic Name: 10-[1-(dimethylamino)propan-2-yl]-N-(phenylmethyl)phenothiazine-2-carboxamide; ethanedioic acid Openeye Name: N-benzyl-10-[2-(dimethylamino)-1-methyl-ethyl]phenothiazine-2-carboxamide; oxalic acid CAS Name: 10-[1-(dimethylamino)propan-2-yl]-N-(phenylmethyl)-2-phenothiazinecarboxamide; oxalic acid IUPAC Name: N-benzyl-10-[1-(dimethylamino)propan-2-yl]phenothiazine-2-carboxamide; oxalic acid Traditional Name: N-benzyl-10-[2-(dimethylamino)-1-methyl-ethyl]phenothiazine-2-carboxamide; oxalic acid Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C)C)N1C2=CC=CC=C2SC3=C1C=C(C=C3)C(=O)NCC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CN(C)C)N1C2=CC=CC=C2SC3=C1C=C(C=C3)C(=O)NCC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H27N3OS.C2H2O4/c1-18(17-27(2)3)28-21-11-7-8-12-23(21)30-24-14-13-20(15-22(24)28)25(29)26-16-19-9-5-4-6-10-19;3-1(4)2(5)6/h4-15,18H,16-17H2,1-3H3,(H,26,29);(H,3,4)(H,5,6)