methyl N-[4-[2-(trifluoromethyl)phenothiazin-10-yl]butyl]carbamate

Systemtic Name: methyl N-[4-[2-(trifluoromethyl)phenothiazin-10-yl]butyl]carbamate Openeye Name: methyl N-[4-[2-(trifluoromethyl)phenothiazin-10-yl]butyl]carbamate CAS Name: N-[4-[2-(trifluoromethyl)-10-phenothiazinyl]butyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-[2-(trifluoromethyl)phenothiazin-10-yl]butyl]carbamate Traditional Name: N-[4-[2-(trifluoromethyl)phenothiazin-10-yl]butyl]carbamic acid methyl ester Formula: C19H19F3N2O2S MolecularWeight: 396.42657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NCCCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(F)(F)F

Isomeric SMILES

COC(=O)NCCCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H19F3N2O2S/c1-26-18(25)23-10-4-5-11-24-14-6-2-3-7-16(14)27-17-9-8-13(12-15(17)24)19(20,21)22/h2-3,6-9,12H,4-5,10-11H2,1H3,(H,23,25)