3,7-bis(2-methylheptan-2-yl)-10H-phenothiazine 5-oxide

Systemtic Name: 3,7-bis(2-methylheptan-2-yl)-10H-phenothiazine 5-oxide Openeye Name: 3,7-bis(1,1-dimethylhexyl)-10H-phenothiazine 5-oxide CAS Name: 3,7-bis(2-methylheptan-2-yl)-10H-phenothiazine 5-oxide IUPAC Name: 3,7-bis(2-methylheptan-2-yl)-10H-phenothiazine 5-oxide Traditional Name: 3,7-bis(1,1-dimethylhexyl)-10H-phenothiazine 5-oxide Formula: C28H41NOS MolecularWeight: 439.69624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C1=CC2=C(C=C1)NC3=C(S2=O)C=C(C=C3)C(C)(C)CCCCC

Isomeric SMILES

CCCCCC(C)(C)C1=CC2=C(C=C1)NC3=C(S2=O)C=C(C=C3)C(C)(C)CCCCC

InChI

InChI=1S/C28H41NOS/c1-7-9-11-17-27(3,4)21-13-15-23-25(19-21)31(30)26-20-22(14-16-24(26)29-23)28(5,6)18-12-10-8-2/h13-16,19-20,29H,7-12,17-18H2,1-6H3