(3-oxidanylpyrrolidin-1-yl)-[10-[1-(pyridin-2-ylmethyl)piperidin-4-yl]phenothiazin-3-yl]methanone

Systemtic Name: (3-oxidanylpyrrolidin-1-yl)-[10-[1-(pyridin-2-ylmethyl)piperidin-4-yl]phenothiazin-3-yl]methanone Openeye Name: (3-hydroxypyrrolidin-1-yl)-[10-[1-(2-pyridylmethyl)-4-piperidyl]phenothiazin-3-yl]methanone CAS Name: (3-hydroxy-1-pyrrolidinyl)-[10-[1-(2-pyridinylmethyl)-4-piperidinyl]-3-phenothiazinyl]methanone IUPAC Name: (3-hydroxypyrrolidin-1-yl)-[10-[1-(pyridin-2-ylmethyl)piperidin-4-yl]phenothiazin-3-yl]methanone Traditional Name: (3-hydroxypyrrolidino)-[10-[1-(2-pyridylmethyl)-4-piperidyl]phenothiazin-3-yl]methanone Formula: C28H30N4O2S MolecularWeight: 486.6284

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=C(C=C(C=C3)C(=O)N4CCC(C4)O)SC5=CC=CC=C52)CC6=CC=CC=N6

Isomeric SMILES

C1CN(CCC1N2C3=C(C=C(C=C3)C(=O)N4CCC(C4)O)SC5=CC=CC=C52)CC6=CC=CC=N6

InChI

InChI=1S/C28H30N4O2S/c33-23-12-16-31(19-23)28(34)20-8-9-25-27(17-20)35-26-7-2-1-6-24(26)32(25)22-10-14-30(15-11-22)18-21-5-3-4-13-29-21/h1-9,13,17,22-23,33H,10-12,14-16,18-19H2