(4-bromophenyl)-[1-[3-(2-propan-2-ylsulfanylphenothiazin-10-yl)propyl]piperidin-4-yl]methanone

Systemtic Name: (4-bromophenyl)-[1-[3-(2-propan-2-ylsulfanylphenothiazin-10-yl)propyl]piperidin-4-yl]methanone Openeye Name: (4-bromophenyl)-[1-[3-(2-isopropylsulfanylphenothiazin-10-yl)propyl]-4-piperidyl]methanone CAS Name: (4-bromophenyl)-[1-[3-[2-(propan-2-ylthio)-10-phenothiazinyl]propyl]-4-piperidinyl]methanone IUPAC Name: (4-bromophenyl)-[1-[3-(2-propan-2-ylsulfanylphenothiazin-10-yl)propyl]piperidin-4-yl]methanone Traditional Name: (4-bromophenyl)-[1-[3-[2-(isopropylthio)phenothiazin-10-yl]propyl]-4-piperidyl]methanone Formula: C30H33BrN2OS2 MolecularWeight: 581.62982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCC(CC4)C(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

CC(C)SC1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCC(CC4)C(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C30H33BrN2OS2/c1-21(2)35-25-12-13-29-27(20-25)33(26-6-3-4-7-28(26)36-29)17-5-16-32-18-14-23(15-19-32)30(34)22-8-10-24(31)11-9-22/h3-4,6-13,20-21,23H,5,14-19H2,1-2H3