3-chloranyl-N-[(4-phenothiazin-10-yl-2-phenyl-2,3-dihydro-1,5-benzothiazepin-3-yl)methyl]aniline

Systemtic Name: 3-chloranyl-N-[(4-phenothiazin-10-yl-2-phenyl-2,3-dihydro-1,5-benzothiazepin-3-yl)methyl]aniline Openeye Name: 3-chloro-N-[(4-phenothiazin-10-yl-2-phenyl-2,3-dihydro-1,5-benzothiazepin-3-yl)methyl]aniline CAS Name: 3-chloro-N-[[4-(10-phenothiazinyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepin-3-yl]methyl]aniline IUPAC Name: 3-chloro-N-[(4-phenothiazin-10-yl-2-phenyl-2,3-dihydro-1,5-benzothiazepin-3-yl)methyl]aniline Traditional Name: (3-chlorophenyl)-[(4-phenothiazin-10-yl-2-phenyl-2,3-dihydro-1,5-benzothiazepin-3-yl)methyl]amine Formula: C34H26ClN3S2 MolecularWeight: 576.17334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(C(=NC3=CC=CC=C3S2)N4C5=CC=CC=C5SC6=CC=CC=C64)CNC7=CC(=CC=C7)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2C(C(=NC3=CC=CC=C3S2)N4C5=CC=CC=C5SC6=CC=CC=C64)CNC7=CC(=CC=C7)Cl

InChI

InChI=1S/C34H26ClN3S2/c35-24-13-10-14-25(21-24)36-22-26-33(23-11-2-1-3-12-23)40-30-18-7-4-15-27(30)37-34(26)38-28-16-5-8-19-31(28)39-32-20-9-6-17-29(32)38/h1-21,26,33,36H,22H2