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

Systemtic Name: 4-[3-[[(3-chlorophenyl)amino]methyl]-4-phenothiazin-10-yl-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxy-phenol Openeye Name: 4-[3-[(3-chloroanilino)methyl]-4-phenothiazin-10-yl-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxy-phenol CAS Name: 4-[3-[(3-chloroanilino)methyl]-4-(10-phenothiazinyl)-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxyphenol IUPAC Name: 4-[3-[(3-chloroanilino)methyl]-4-phenothiazin-10-yl-2,3-dihydro-1,5-benzoxazepin-2-yl]-2-methoxyphenol Traditional Name: 4-[3-[(3-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=C7)Cl)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(C(=NC3=CC=CC=C3O2)N4C5=CC=CC=C5SC6=CC=CC=C64)CNC7=CC(=CC=C7)Cl)O

InChI

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