1-butyl-10H-phenothiazine; 1,2-dioctyl-10H-phenothiazine

Systemtic Name: 1-butyl-10H-phenothiazine; 1,2-dioctyl-10H-phenothiazine Openeye Name: 1-butyl-10H-phenothiazine; 1,2-dioctyl-10H-phenothiazine CAS Name: 1-butyl-10H-phenothiazine; 1,2-dioctyl-10H-phenothiazine IUPAC Name: 1-butyl-10H-phenothiazine; 1,2-dioctyl-10H-phenothiazine Traditional Name: 1-butyl-10H-phenothiazine; 1,2-dioctyl-10H-phenothiazine Formula: C44H58N2S2 MolecularWeight: 679.07472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C2=C(C=C1)SC3=CC=CC=C3N2)CCCCCCCC.CCCCC1=C2C(=CC=C1)SC3=CC=CC=C3N2

Isomeric SMILES

CCCCCCCCC1=C(C2=C(C=C1)SC3=CC=CC=C3N2)CCCCCCCC.CCCCC1=C2C(=CC=C1)SC3=CC=CC=C3N2

InChI

InChI=1S/C28H41NS.C16H17NS/c1-3-5-7-9-11-13-17-23-21-22-27-28(24(23)18-14-12-10-8-6-4-2)29-25-19-15-16-20-26(25)30-27;1-2-3-7-12-8-6-11-15-16(12)17-13-9-4-5-10-14(13)18-15/h15-16,19-22,29H,3-14,17-18H2,1-2H3;4-6,8-11,17H,2-3,7H2,1H3