(1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl) 2-phenyl-3H-benzimidazole-5-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl) 2-phenyl-3H-benzimidazole-5-carboxylate Openeye Name: 1-(phenothiazine-10-carbonyl)propyl 2-phenyl-3H-benzimidazole-5-carboxylate CAS Name: 2-phenyl-3H-benzimidazole-5-carboxylic acid [1-oxo-1-(10-phenothiazinyl)butan-2-yl] ester IUPAC Name: (1-oxo-1-phenothiazin-10-ylbutan-2-yl) 2-phenyl-3H-benzimidazole-5-carboxylate Traditional Name: 2-phenyl-3H-benzimidazole-5-carboxylic acid 1-(phenothiazine-10-carbonyl)propyl ester Formula: C30H23N3O3S MolecularWeight: 505.58692

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)OC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CC=CC=C6

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)OC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CC=CC=C6

InChI

InChI=1S/C30H23N3O3S/c1-2-25(29(34)33-23-12-6-8-14-26(23)37-27-15-9-7-13-24(27)33)36-30(35)20-16-17-21-22(18-20)32-28(31-21)19-10-4-3-5-11-19/h3-18,25H,2H2,1H3,(H,31,32)