1,2-dimethyl-10-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]phenothiazine 5-oxide

Systemtic Name: 1,2-dimethyl-10-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]phenothiazine 5-oxide Openeye Name: 10-[3-(4-benzylpiperazin-1-yl)propyl]-1,2-dimethyl-phenothiazine 5-oxide CAS Name: 1,2-dimethyl-10-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]phenothiazine 5-oxide IUPAC Name: 10-[3-(4-benzylpiperazin-1-yl)propyl]-1,2-dimethylphenothiazine 5-oxide Traditional Name: 10-[3-(4-benzylpiperazino)propyl]-1,2-dimethyl-phenothiazine 5-oxide Formula: C28H33N3OS MolecularWeight: 459.64612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCN4CCN(CC4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCN4CCN(CC4)CC5=CC=CC=C5)C

InChI

InChI=1S/C28H33N3OS/c1-22-13-14-27-28(23(22)2)31(25-11-6-7-12-26(25)33(27)32)16-8-15-29-17-19-30(20-18-29)21-24-9-4-3-5-10-24/h3-7,9-14H,8,15-21H2,1-2H3