1,2-bis(6-methylheptyl)-10-prop-2-enyl-phenothiazine

Systemtic Name: 1,2-bis(6-methylheptyl)-10-prop-2-enyl-phenothiazine Openeye Name: 10-allyl-1,2-bis(6-methylheptyl)phenothiazine CAS Name: 1,2-bis(6-methylheptyl)-10-prop-2-enylphenothiazine IUPAC Name: 1,2-bis(6-methylheptyl)-10-prop-2-enylphenothiazine Traditional Name: 10-allyl-1,2-bis(6-methylheptyl)phenothiazine Formula: C31H45NS MolecularWeight: 463.7607

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC1=C(C2=C(C=C1)SC3=CC=CC=C3N2CC=C)CCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCC1=C(C2=C(C=C1)SC3=CC=CC=C3N2CC=C)CCCCCC(C)C

InChI

InChI=1S/C31H45NS/c1-6-23-32-28-19-13-14-20-29(28)33-30-22-21-26(17-11-7-9-15-24(2)3)27(31(30)32)18-12-8-10-16-25(4)5/h6,13-14,19-22,24-25H,1,7-12,15-18,23H2,2-5H3