4-[3-[[(2-chlorophenyl)amino]methyl]-4-phenothiazin-10-yl-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxy-phenol

Systemtic Name: 4-[3-[[(2-chlorophenyl)amino]methyl]-4-phenothiazin-10-yl-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxy-phenol Openeye Name: 4-[3-[(2-chloroanilino)methyl]-4-phenothiazin-10-yl-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxy-phenol CAS Name: 4-[3-[(2-chloroanilino)methyl]-4-(10-phenothiazinyl)-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxyphenol IUPAC Name: 4-[3-[(2-chloroanilino)methyl]-4-phenothiazin-10-yl-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxyphenol Traditional Name: 4-[3-[(2-chloroanilino)methyl]-4-phenothiazin-10-yl-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxy-phenol Formula: C35H28ClN3O3S MolecularWeight: 606.13312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(C(=NC3=CC=CC=C3O2)N4C5=CC=CC=C5SC6=CC=CC=C64)CNC7=CC=CC=C7Cl)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(C(=NC3=CC=CC=C3O2)N4C5=CC=CC=C5SC6=CC=CC=C64)CNC7=CC=CC=C7Cl)O

InChI

InChI=1S/C35H28ClN3O3S/c1-41-31-20-22(18-19-29(31)40)34-23(21-37-25-11-3-2-10-24(25)36)35(38-26-12-4-7-15-30(26)42-34)39-27-13-5-8-16-32(27)43-33-17-9-6-14-28(33)39/h2-20,23,34,37,40H,21H2,1H3