3-[2-[(4-tert-butylphenoxy)methyl]phenothiazin-10-yl]-N,N-dimethyl-propan-1-amine

Systemtic Name: 3-[2-[(4-tert-butylphenoxy)methyl]phenothiazin-10-yl]-N,N-dimethyl-propan-1-amine Openeye Name: 3-[2-[(4-tert-butylphenoxy)methyl]phenothiazin-10-yl]-N,N-dimethyl-propan-1-amine CAS Name: 3-[2-[(4-tert-butylphenoxy)methyl]-10-phenothiazinyl]-N,N-dimethyl-1-propanamine IUPAC Name: 3-[2-[(4-tert-butylphenoxy)methyl]phenothiazin-10-yl]-N,N-dimethylpropan-1-amine Traditional Name: 3-[2-[(4-tert-butylphenoxy)methyl]phenothiazin-10-yl]propyl-dimethyl-amine Formula: C28H34N2OS MolecularWeight: 446.64736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC2=CC3=C(C=C2)SC4=CC=CC=C4N3CCCN(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC2=CC3=C(C=C2)SC4=CC=CC=C4N3CCCN(C)C

InChI

InChI=1S/C28H34N2OS/c1-28(2,3)22-12-14-23(15-13-22)31-20-21-11-16-27-25(19-21)30(18-8-17-29(4)5)24-9-6-7-10-26(24)32-27/h6-7,9-16,19H,8,17-18,20H2,1-5H3